C19H18ClN5OS2
5-[(2-chlorophenyl)methylsulfanyl]-14,14-dimethyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine
Also Known As: 3-((2-chlorobenzyl)thio)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-5-amine|3-[(2-chlorobenzyl)sulfanyl]-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-5-amine
| Molecular Formula | C19H18ClN5OS2 |
|---|---|
| Molecular Weight | 431.06412 g/mol |
| LogP | 4.7182 |
| Topological Polar Surface Area | 78.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 431.06412 |
| Monoisotopic Mass | 431.06412 |
| Heavy Atoms | 28 |
| Complexity | 1216.201 |
Chemical Identifiers
| CAS Number | 577695-05-7 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C4=NN=C(N4C(=N3)N)SCC5=CC=CC=C5Cl)C |
Product Overview
C19H18ClN5OS2 (CAS 577695-05-7), with molecular formula C19H18ClN5OS2 and molecular weight 431.06412 g/mol. IUPAC: 5-[(2-chlorophenyl)methylsulfanyl]-14,14-dimethyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-amine.
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