4-(2-chloro-6-fluorophenyl)-N,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Chemical Structure Depiction of
4-(2-chloro-6-fluorophenyl)-N,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide
4-(2-chloro-6-fluorophenyl)-N,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | 4681-2929 |
| Compound Name: | 4-(2-chloro-6-fluorophenyl)-N,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide |
| Molecular Weight: | 313.78 |
| Molecular Formula: | C13 H13 Cl F N3 O S |
| Smiles: | CC1=C(C(c2c(cccc2[Cl])F)NC(N1)=S)C(NC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5557 |
| logD: | 1.5539 |
| logSw: | -2.4315 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 47.509 |
| InChI Key: | BYHLHDGRHUPJDO-NSHDSACASA-N |