ethyl 2-{[5-(3-chloro-2-methylphenyl)furan-2-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(3-chloro-2-methylphenyl)furan-2-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{[5-(3-chloro-2-methylphenyl)furan-2-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3901-0102 |
| Compound Name: | ethyl 2-{[5-(3-chloro-2-methylphenyl)furan-2-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 443.95 |
| Molecular Formula: | C23 H22 Cl N O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1ccc(c2cccc(c2C)[Cl])o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3512 |
| logD: | 3.7392 |
| logSw: | -6.2095 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.198 |
| InChI Key: | CISFUJIXBIRJDG-UHFFFAOYSA-N |