propan-2-yl 6-methyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 6-methyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 6-methyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6049-1232 |
| Compound Name: | propan-2-yl 6-methyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C27 H27 N O4 S |
| Smiles: | CC1CCc2c(C(=O)OC(C)C)c(NC(C3c4ccccc4Oc4ccccc34)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3044 |
| logD: | -0.1661 |
| logSw: | -5.6566 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.291 |
| InChI Key: | HXFABDPLCXCWIS-MRXNPFEDSA-N |