5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0861 |
| Compound Name: | 5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 473.95 |
| Molecular Formula: | C16 H13 Cl F N5 O3 S3 |
| Smiles: | CCSc1nnc(NC(c2c(cnc(n2)S(Cc2ccccc2F)(=O)=O)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3383 |
| logD: | 2.7122 |
| logSw: | -4.3622 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.413 |
| InChI Key: | DDFMVNJZCLGMQM-UHFFFAOYSA-N |