methyl 6-tert-butyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 6-tert-butyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 6-tert-butyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6048-0240 |
| Compound Name: | methyl 6-tert-butyl-2-[(9H-xanthene-9-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C28 H29 N O4 S |
| Smiles: | CC(C)(C)C1CCc2c(C(=O)OC)c(NC(C3c4ccccc4Oc4ccccc34)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5352 |
| logD: | 0.0646 |
| logSw: | -5.8481 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.032 |
| InChI Key: | BNKFTKHLTWQKBT-MRXNPFEDSA-N |