N-benzyl-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-benzyl-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | K783-6675 |
Compound Name: | N-benzyl-4-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 408.95 |
Molecular Formula: | C23 H21 Cl N2 O S |
Smiles: | C(c1ccccc1)NC(c1ccc2c(c1)N(CCS2)Cc1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 4.9879 |
logD: | 4.9879 |
logSw: | -5.3005 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 27.2145 |
InChI Key: | MZJOJXOLQFWTCR-UHFFFAOYSA-N |