methyl 4-(4-butoxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-(4-butoxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-(4-butoxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8013-7391 |
| Compound Name: | methyl 4-(4-butoxy-3-methoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 364.46 |
| Molecular Formula: | C18 H24 N2 O4 S |
| Smiles: | CCCCOc1ccc(cc1OC)C1C(=C(C)NC(N1)=S)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1219 |
| logD: | 3.1059 |
| logSw: | -3.3031 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.983 |
| InChI Key: | QCFPBXMJWCLKFG-MRXNPFEDSA-N |