4-methyl-N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzamide
Chemical Structure Depiction of
4-methyl-N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzamide
4-methyl-N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzamide
Compound characteristics
| Compound ID: | F536-0030 |
| Compound Name: | 4-methyl-N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzamide |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C23 H26 N4 O6 S |
| Smiles: | Cc1ccc(cc1)C(NCC(N1CCN(CC1)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1211 |
| logD: | 1.1206 |
| logSw: | -2.4478 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.833 |
| InChI Key: | CTNRVGVRAKPWSN-UHFFFAOYSA-N |