N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methylbutyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methylbutyl)thiophene-2-carboxamide
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methylbutyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V023-8962 |
| Compound Name: | N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methylbutyl)thiophene-2-carboxamide |
| Molecular Weight: | 531.14 |
| Molecular Formula: | C27 H31 Cl N2 O3 S2 |
| Smiles: | CC(C)CCN(CC(N1CCc2c(ccs2)C1COc1ccc(c(C)c1)[Cl])=O)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0047 |
| logD: | 7.0047 |
| logSw: | -6.454 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.283 |
| InChI Key: | RGCGYPQNYSRMFR-QHCPKHFHSA-N |