N-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
N-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | G755-0672 |
| Compound Name: | N-(5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide |
| Molecular Weight: | 435.93 |
| Molecular Formula: | C16 H10 Cl N5 O2 S3 |
| Smiles: | C(C1=CC(N2C=C(C=CC2=N1)[Cl])=O)Sc1nnc(NC(c2cccs2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0916 |
| logD: | 3.0856 |
| logSw: | -3.6645 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.488 |
| InChI Key: | CIFRWDGNLYDNHL-UHFFFAOYSA-N |