N-(5-{[(7-methyl-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-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
N-(5-{[(7-methyl-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: | G755-0473 |
| Compound Name: | N-(5-{[(7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C17 H13 N5 O2 S3 |
| Smiles: | CC1C=CC2=NC(CSc3nnc(NC(c4cccs4)=O)s3)=CC(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2628 |
| logD: | 3.2568 |
| logSw: | -3.4229 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.488 |
| InChI Key: | FYSCKYKSNFYXGQ-UHFFFAOYSA-N |