4-[(2,5-dimethylphenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(2,5-dimethylphenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(2,5-dimethylphenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C122-0436 |
Compound Name: | 4-[(2,5-dimethylphenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 439.58 |
Molecular Formula: | C24 H29 N3 O3 S |
Smiles: | Cc1ccc(C)c(CN2C(CSc3ccc(cc23)C(NCCN2CCOCC2)=O)=O)c1 |
Stereo: | ACHIRAL |
logP: | 3.0879 |
logD: | 3.0738 |
logSw: | -3.1829 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.765 |
InChI Key: | CAIIPQCESVEUGI-UHFFFAOYSA-N |