Cas no 31375-20-9 (Methanethioamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-)
![Methanethioamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]- structure](https://ossimg.kuujia.com/scimg/31500/31375-20-9x500.png)
31375-20-9 structure
Product Name:Methanethioamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-
CAS No:31375-20-9
MF:C7H10N4S
MW:182.246098995209
CID:320023
PubChem ID:16205059
Update Time:2025-04-19
Methanethioamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Methanethioamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-
- N-[(4-amino-2-methylpyrimidin-5-yl)methyl]methanethioamide
- N-((4-Amino-2-methyl-5-pyrimidyl)methyl)thioformamide
- N-[(4-amino-2-methylpyrimidin-5-yl)methyl]thioformamide
- 2-Methyl-4-amino-5-thioformylaminomethyl-pyrimidin
- NS00029073
- 31375-20-9
- 9SGY74L2GT
- DTXSID40185300
- N-[(4-AMINO-2-METHYL-5-PYRIMIDYL)METHYL]THIOFORMAMIDE
- SCHEMBL13177070
- EINECS 250-601-9
- METHANETHIOAMIDE, N-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)-
- UNII-9SGY74L2GT
-
- Inchi： 1S/C7H10N4S/c1-5-10-3-6(2-9-4-12)7(8)11-5/h3-4H,2H2,1H3,(H,9,12)(H2,8,10,11)
- InChI Key： FWUKTPVTANTBJJ-UHFFFAOYSA-N
- SMILES： S=CNCC1=CN=C(C)N=C1N
Computed Properties
- Exact Mass: 182.0628
- Monoisotopic Mass: 182.062617
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 152
- 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
- Topological Polar Surface Area: 95.9
- XLogP3: 0.5
Experimental Properties
- Density: 1.29
- Boiling Point: 362.5°Cat760mmHg
- Flash Point: 173.1°C
- Refractive Index: 1.659
- PSA: 63.83
Methanethioamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]- Related Literature
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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