N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y503-0528 |
| Compound Name: | N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide |
| Molecular Weight: | 461.6 |
| Molecular Formula: | C25 H23 N3 O2 S2 |
| Smiles: | Cc1ccc(c2cc(C(Nc3c(C(N)=O)c4CCCCCc4s3)=O)c3ccccc3n2)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.2846 |
| logD: | 5.0366 |
| logSw: | -5.3929 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.512 |
| InChI Key: | YSDLUNOZBTVBJJ-UHFFFAOYSA-N |