N-(3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-chlorophenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-chlorophenyl)quinoline-4-carboxamide
N-(3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-chlorophenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y503-0602 |
| Compound Name: | N-(3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-chlorophenyl)quinoline-4-carboxamide |
| Molecular Weight: | 504.05 |
| Molecular Formula: | C28 H26 Cl N3 O2 S |
| Smiles: | CCCC1CCc2c(C(N)=O)c(NC(c3cc(c4ccccc4[Cl])nc4ccccc34)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1621 |
| logD: | 5.924 |
| logSw: | -6.103 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.163 |
| InChI Key: | UKYVDADAJIFNIV-MRXNPFEDSA-N |