6-chloro-7-[4-(4-propylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-7-[4-(4-propylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-chloro-7-[4-(4-propylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-1297 |
| Compound Name: | 6-chloro-7-[4-(4-propylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 485 |
| Molecular Formula: | C21 H29 Cl N4 O5 S |
| Smiles: | CCCN1CCN(CC1)C(C1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2664 |
| logD: | 0.815 |
| logSw: | -2.9158 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.658 |
| InChI Key: | QPTFERNXWFBCRA-UHFFFAOYSA-N |