propan-2-yl 2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
propan-2-yl 2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-9114 |
| Compound Name: | propan-2-yl 2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate |
| Molecular Weight: | 531.71 |
| Molecular Formula: | C32 H37 N O4 S |
| Smiles: | CC(C)OC(c1c2CCCCCCCCCCc2sc1NC(C1c2ccccc2Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.846 |
| logD: | 2.3754 |
| logSw: | -5.8986 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.622 |
| InChI Key: | BJSAWPVRCSOQDH-UHFFFAOYSA-N |