Cas no 72704-63-3 (5-(morpholin-4-ylmethyl)-1h-pyrimidine-2,4-dione)
72704-63-3 structure
Product Name:5-(morpholin-4-ylmethyl)-1h-pyrimidine-2,4-dione
CAS No:72704-63-3
MF:C9H13N3O3
MW:211.217821836472
CID:977452
PubChem ID:235247
Update Time:2025-04-19
5-(morpholin-4-ylmethyl)-1h-pyrimidine-2,4-dione Chemical and Physical Properties
Names and Identifiers
-
- 5-(morpholin-4-ylmethyl)-1h-pyrimidine-2,4-dione
- 5-(4-Morpholinylmethyl)-2,4-pyrimidinediol
- 5-(morpholin-4-ylmethyl)pyrimidine-2,4(1h,3h)-dione
- 5-(morpholinomethyl)uracil
- 5-morpholin-4-ylmethyl-1H-pyrimidine-2,4-dione
- 5-Morpholinomethyl-uracil
- 5-N-morpholinomethyluracil
- AC1L5TYN
- AC1Q6FTF
- CBMicro_019061
- CTK5D6676
- NSC36418
- Oprea1_481097
- 20DE5GXO76
- SR-01000402003-1
- Cambridge id 5343476
- 2,4(1H,3H)-Pyrimidinedione, 5-(4-morpholinylmethyl)-
- UNII-20DE5GXO76
- 72704-63-3
- SR-01000402003
- DTXSID10223006
- BIM-0019049.P001
- HMS3078E19
- 5-(morpholinomethyl)pyrimidine-2,4-diol
- EU-0001726
- NSC 36418
- 5-(morpholin-4-yl-methyl)-1H-pyrimidine-2,4-dione
- SMR001526731
- 5-(4-morpholinylmethyl)-2,4(1H,3H)-pyrimidinedione
- URACIL, 5-MORPHOLINOMETHYL-
- SDCCGMLS-0064837.P001
- 5-(Morpholinomethyl)pyrimidine-2,4(1H,3H)-dione
- CCG-6722
- 5-Morpholinomethyluracil
- CHEMBL3184050
- AKOS000656419
- SCHEMBL16796290
- NSC-36418
- MLS002607973
-
- Inchi： 1S/C9H13N3O3/c13-8-7(5-10-9(14)11-8)6-12-1-3-15-4-2-12/h5H,1-4,6H2,(H2,10,11,13,14)
- InChI Key： MCFFNLIPFGEAOH-UHFFFAOYSA-N
- SMILES： O1CCN(CC2=CNC(NC2=O)=O)CC1
Computed Properties
- Exact Mass: 211.09579
- Monoisotopic Mass: 211.09569129g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 308
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -2.1
- Topological Polar Surface Area: 70.7?2
Experimental Properties
- PSA: 70.67
- LogP: -1.16670
5-(morpholin-4-ylmethyl)-1h-pyrimidine-2,4-dione Related Literature
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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