N-(4-fluorophenyl)-3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)propanamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)propanamide
N-(4-fluorophenyl)-3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)propanamide
Compound characteristics
Compound ID: | L705-2417 |
Compound Name: | N-(4-fluorophenyl)-3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)propanamide |
Molecular Weight: | 422.5 |
Molecular Formula: | C19 H19 F N2 O4 S2 |
Smiles: | CC1CSc2ccc(cc2NC1=O)S(CCC(Nc1ccc(cc1)F)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4684 |
logD: | 2.4673 |
logSw: | -2.9824 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.361 |
InChI Key: | UTMJZHDHIQQRHS-GFCCVEGCSA-N |