6-chloro-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
6-chloro-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
6-chloro-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | G805-0818 |
| Compound Name: | 6-chloro-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 463.98 |
| Molecular Formula: | C22 H26 Cl N3 O4 S |
| Smiles: | Cc1cccc(CN2CCC(CC2)CNS(c2cc3c(cc2[Cl])NC(CO3)=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5891 |
| logD: | 1.5229 |
| logSw: | -3.8261 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79 |
| InChI Key: | CACJZEDOXIPFGH-UHFFFAOYSA-N |