N-(4-chloro-2-fluorophenyl)-2-{[2-(dipropylamino)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-{[2-(dipropylamino)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
N-(4-chloro-2-fluorophenyl)-2-{[2-(dipropylamino)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | F813-4717 |
Compound Name: | N-(4-chloro-2-fluorophenyl)-2-{[2-(dipropylamino)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetamide |
Molecular Weight: | 453.99 |
Molecular Formula: | C19 H21 Cl F N5 O S2 |
Smiles: | CCCN(CCC)c1nc2c(c(ncn2)SCC(Nc2ccc(cc2F)[Cl])=O)s1 |
Stereo: | ACHIRAL |
logP: | 5.5235 |
logD: | 5.5142 |
logSw: | -5.8348 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.465 |
InChI Key: | VUPCPMJRHJTVPR-UHFFFAOYSA-N |