N~1~-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~4~-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide
Chemical Structure Depiction of
N~1~-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~4~-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide
N~1~-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~4~-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide
Compound characteristics
| Compound ID: | C204-0382 |
| Compound Name: | N~1~-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~4~-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C28 H33 N5 O4 |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)NC(CCC(Nc1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9222 |
| logD: | 2.2348 |
| logSw: | -3.1022 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.872 |
| InChI Key: | NCLGRTMXQSSWPR-UHFFFAOYSA-N |