3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(2,4,6-trimethylphenyl)propanamide
Chemical Structure Depiction of
3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(2,4,6-trimethylphenyl)propanamide
3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(2,4,6-trimethylphenyl)propanamide
Compound characteristics
| Compound ID: | L705-2473 |
| Compound Name: | 3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(2,4,6-trimethylphenyl)propanamide |
| Molecular Weight: | 446.59 |
| Molecular Formula: | C22 H26 N2 O4 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(CCC(Nc1c(C)cc(C)cc1C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9526 |
| logD: | 2.9524 |
| logSw: | -3.1922 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.965 |
| InChI Key: | ZLAYIZPEWOJTKH-MRXNPFEDSA-N |