N-[(3-methoxyphenyl)methyl]-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
N-[(3-methoxyphenyl)methyl]-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Compound characteristics
| Compound ID: | T408-0535 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide |
| Molecular Weight: | 398.52 |
| Molecular Formula: | C22 H26 N2 O3 S |
| Smiles: | COc1cccc(CNC(C2CCc3c(C2)cc(C(N2CCCC2)=O)s3)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5111 |
| logD: | 3.5111 |
| logSw: | -3.7379 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.149 |
| InChI Key: | KXDTUOZWJGVLHN-MRXNPFEDSA-N |