propyl 2-[(9H-xanthene-9-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
propyl 2-[(9H-xanthene-9-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
propyl 2-[(9H-xanthene-9-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6048-0217 |
| Compound Name: | propyl 2-[(9H-xanthene-9-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C27 H27 N O4 S |
| Smiles: | CCCOC(c1c2CCCCCc2sc1NC(C1c2ccccc2Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3679 |
| logD: | -0.1026 |
| logSw: | -5.6165 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.237 |
| InChI Key: | ZMWROJVWPQTMGK-UHFFFAOYSA-N |