7-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-0865 |
| Compound Name: | 7-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 547.07 |
| Molecular Formula: | C26 H31 Cl N4 O5 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(C1CCN(CC1)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2945 |
| logD: | 3.294 |
| logSw: | -3.6014 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.827 |
| InChI Key: | AMTNFFSTUGEZMM-UHFFFAOYSA-N |