4-[(4-methylphenyl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-methylphenyl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(4-methylphenyl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C699-0443 |
Compound Name: | 4-[(4-methylphenyl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 409.59 |
Molecular Formula: | C24 H31 N3 O S |
Smiles: | Cc1ccc(CN2CCSc3ccc(cc23)C(NCCCN2CCCC2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.7547 |
logD: | 0.7222 |
logSw: | -3.8916 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 31.4045 |
InChI Key: | MIFQQHLZTGCWIB-UHFFFAOYSA-N |