methyl 1-ethyl-6-methyl-4-{4-[(naphthalene-1-sulfonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-6-methyl-4-{4-[(naphthalene-1-sulfonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 1-ethyl-6-methyl-4-{4-[(naphthalene-1-sulfonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V009-8246 |
| Compound Name: | methyl 1-ethyl-6-methyl-4-{4-[(naphthalene-1-sulfonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 495.62 |
| Molecular Formula: | C25 H25 N3 O4 S2 |
| Salt: | not_available |
| Smiles: | CCN1C(C)=C(C(c2ccc(cc2)NS(c2cccc3ccccc23)(=O)=O)NC1=S)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1949 |
| logD: | 4.0079 |
| logSw: | -4.3335 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.024 |
| InChI Key: | ZTTDVWRIRQZMSA-QHCPKHFHSA-N |