N-(3-chlorophenyl)-N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)urea
Chemical Structure Depiction of
N-(3-chlorophenyl)-N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)urea
N-(3-chlorophenyl)-N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)urea
Compound characteristics
| Compound ID: | Y203-7862 |
| Compound Name: | N-(3-chlorophenyl)-N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)urea |
| Molecular Weight: | 345.85 |
| Molecular Formula: | C17 H16 Cl N3 O S |
| Smiles: | CC1CCc2c(C#N)c(NC(Nc3cccc(c3)[Cl])=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.425 |
| logD: | 4.2693 |
| logSw: | -6.0287 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.313 |
| InChI Key: | ZIFICGFRTRPOHZ-SNVBAGLBSA-N |