6-(morpholine-4-sulfonyl)-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(morpholine-4-sulfonyl)-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-2H-1,4-benzoxazin-3(4H)-one
6-(morpholine-4-sulfonyl)-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0803 |
| Compound Name: | 6-(morpholine-4-sulfonyl)-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 604.68 |
| Molecular Formula: | C28 H36 N4 O9 S |
| Smiles: | COc1ccc(CN2CCN(CC2)C(CN2C(COc3ccc(cc23)S(N2CCOCC2)(=O)=O)=O)=O)c(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 0.7777 |
| logD: | 0.5772 |
| logSw: | -2.3852 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 106.685 |
| InChI Key: | CONLTWDKPNIPEU-UHFFFAOYSA-N |