Cas no 172758-08-6 (Propanamide,N-[3,4,5,6,7,8-hexahydro-6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-2-pteridinyl]-2-methyl-)
172758-08-6 structure
Product Name:Propanamide,N-[3,4,5,6,7,8-hexahydro-6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-2-pteridinyl]-2-methyl-
CAS No:172758-08-6
MF:C18H22N6O3
MW:370.405683040619
CID:111539
PubChem ID:135401448
Update Time:2025-04-18
Propanamide,N-[3,4,5,6,7,8-hexahydro-6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-2-pteridinyl]-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Propanamide,N-[3,4,5,6,7,8-hexahydro-6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-2-pteridinyl]-2-methyl-
- N-[1,4,5,6,7,8-HEXAHYDRO-6,7-DIMETHYL-4-OXO-5-(3-PYRIDINYLCARBONYL)-2-PTERIDINYL]-2-METHYL-PROPANAMIDE
- N-[6,7-dimethyl-4-oxo-5-(pyridine-3-carbonyl)-1,6,7,8-tetrahydropteridin-2-yl]-2-methylpropanamide
- Propanamide,N-[3,4,5,6,7,8-hexahydro-6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-2-pteridinyl]-...
- N-[6,7-dimethyl-4-oxo-5-(pyridine-3-carbonyl)-3,6,7,8-tetrahydropteridin-2-yl]-2-methylpropanamide
- Oprea1_409503
- N-[6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-3,4,5,6,7,8-hexahydro-2-pteridinyl]-2-methylpropanamide
- DTXSID20393022
- SMR000230402
- 172758-08-6
- N-[1,4,5,6,7,8-Hexahydro-6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-2-pteridinyl]-2-methyl-propanami
- CHEMBL1585346
- AB-323/13887368
- HMS2524N10
- FT-0629612
- MLS000704542
- N-[1,4,5,6,7,8-HEXAHYDRO-6,7-DIMETHYL-4-OXO-5-(3-PYRIDINYLCARBONYL)-2-PTERIDINYL]-2-METHYL-PRO
-
- Inchi: 1S/C18H22N6O3/c1-9(2)15(25)22-18-21-14-13(16(26)23-18)24(11(4)10(3)20-14)17(27)12-6-5-7-19-8-12/h5-11H,1-4H3,(H3,20,21,22,23,25,26)
- InChI Key: IQNMVFBOBKVYSC-UHFFFAOYSA-N
- SMILES: O=C(C1C=NC=CC=1)N1C2C(NC(NC(C(C)C)=O)=NC=2NC(C)C1C)=O
Computed Properties
- Exact Mass: 370.175
- Monoisotopic Mass: 370.175
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 27
- Rotatable Bond Count: 3
- Complexity: 714
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.9
- Topological Polar Surface Area: 116?2
Experimental Properties
- Density: 1.42
- Refractive Index: 1.687
Propanamide,N-[3,4,5,6,7,8-hexahydro-6,7-dimethyl-4-oxo-5-(3-pyridinylcarbonyl)-2-pteridinyl]-2-methyl- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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