Cas no 16837-09-5 (4(1H)-Pyrimidinone,6-amino-2,3-dihydro-1-propyl-2-thioxo-)
16837-09-5 structure
Product Name:4(1H)-Pyrimidinone,6-amino-2,3-dihydro-1-propyl-2-thioxo-
CAS No:16837-09-5
MF:C7H11N3OS
MW:185.246739625931
CID:198554
PubChem ID:816920
Update Time:2025-04-19
4(1H)-Pyrimidinone,6-amino-2,3-dihydro-1-propyl-2-thioxo- Chemical and Physical Properties
Names and Identifiers
-
- 4(1H)-Pyrimidinone,6-amino-2,3-dihydro-1-propyl-2-thioxo-
- 1-propyl-1H-pyrazol-5-amine
- 1-Propyl-5-amino-pyrazol
- 1-Propyl-6-amino-thiouracil
- 1-propylpyrazole-5-ylamine
- 2-propyl-2H-pyrazol-3-ylamine
- 6-amino-1-propyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one
- AC1LLIFC
- AC1Q2XZF
- SBB007271
- SureCN2340816
- 6-amino-1-propyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
- AB-323/25048055
- NCIOpen2_001796
- 6-amino-1-propyl-2-sulfanylidenepyrimidin-4-one
- NSC101993
- DTXSID80937481
- NSC-101993
- 6-Amino-4-hydroxy-1-propylpyrimidine-2(1H)-thione
- AKOS006280213
- 16837-09-5
-
- Inchi： 1S/C7H11N3OS/c1-2-3-10-5(8)4-6(11)9-7(10)12/h4H,2-3,8H2,1H3,(H,9,11,12)
- InChI Key： SMHJPGXXWFYLLL-UHFFFAOYSA-N
- SMILES： S=C1NC(C=C(N)N1CCC)=O
Computed Properties
- Exact Mass: 185.06243
- Monoisotopic Mass: 185.06228316g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 249
- 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: 0.2
- Topological Polar Surface Area: 90.4?2
Experimental Properties
- PSA: 58.36
- LogP: 1.47930
4(1H)-Pyrimidinone,6-amino-2,3-dihydro-1-propyl-2-thioxo- Related Literature
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
16837-09-5 (4(1H)-Pyrimidinone,6-amino-2,3-dihydro-1-propyl-2-thioxo-) Related Products
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