ethyl 4-{3-[(benzenesulfonyl)amino]phenyl}-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[(benzenesulfonyl)amino]phenyl}-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-{3-[(benzenesulfonyl)amino]phenyl}-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V012-4006 |
| Compound Name: | ethyl 4-{3-[(benzenesulfonyl)amino]phenyl}-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C22 H25 N3 O4 S2 |
| Smiles: | CCN1C(C)=C(C(c2cccc(c2)NS(c2ccccc2)(=O)=O)NC1=S)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7649 |
| logD: | 3.7278 |
| logSw: | -3.8849 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.875 |
| InChI Key: | OBHSVXUZTAESFF-FQEVSTJZSA-N |