ethyl 2-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | G331-0614 |
| Compound Name: | ethyl 2-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 472.01 |
| Molecular Formula: | C24 H26 Cl N3 O3 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(NCc1cccn1Cc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4326 |
| logD: | 4.4436 |
| logSw: | -6.0639 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.403 |
| InChI Key: | LBPIJRNPFVPUTN-UHFFFAOYSA-N |