5-chloro-N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-sulfonamide
Chemical Structure Depiction of
5-chloro-N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-sulfonamide
5-chloro-N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | F881-0389 |
| Compound Name: | 5-chloro-N-(2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)thiophene-2-sulfonamide |
| Molecular Weight: | 478.01 |
| Molecular Formula: | C20 H16 Cl N3 O3 S3 |
| Smiles: | CC1=CC=CN2C1=NC(CSc1ccccc1NS(c1ccc(s1)[Cl])(=O)=O)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 4.0202 |
| logD: | 4.0118 |
| logSw: | -4.308 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.944 |
| InChI Key: | MPXOIMRNFYBLEU-UHFFFAOYSA-N |