methyl 2-[(3-chlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(3-chlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-[(3-chlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3448-5634 |
| Compound Name: | methyl 2-[(3-chlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 364.85 |
| Molecular Formula: | C17 H17 Cl N2 O3 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0711 |
| logD: | 2.9138 |
| logSw: | -5.3673 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.43 |
| InChI Key: | ALNNRTDZTKNXBV-UHFFFAOYSA-N |