N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-3-[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]propanamide
Chemical Structure Depiction of
N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-3-[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]propanamide
N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-3-[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]propanamide
Compound characteristics
| Compound ID: | L058-0734 |
| Compound Name: | N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-3-[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]propanamide |
| Molecular Weight: | 495.02 |
| Molecular Formula: | C27 H31 Cl N4 O3 |
| Smiles: | C=CCN1C(C(N(CCC(NCC2CCN(CC2)Cc2ccc(cc2)[Cl])=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3811 |
| logD: | 1.7448 |
| logSw: | -3.7416 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.956 |
| InChI Key: | MFHUIRYOEBHLHC-UHFFFAOYSA-N |