2-[7-chloro-3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-[2-(pyrrolidin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[7-chloro-3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-[2-(pyrrolidin-1-yl)ethyl]acetamide
2-[7-chloro-3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-[2-(pyrrolidin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | V004-1230 |
| Compound Name: | 2-[7-chloro-3-(3-nitrophenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]-N-[2-(pyrrolidin-1-yl)ethyl]acetamide |
| Molecular Weight: | 471.9 |
| Molecular Formula: | C22 H22 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)CCNC(CN1C(N(C(c2ccc(cc12)[Cl])=O)c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9435 |
| logD: | 0.0047 |
| logSw: | -3.313 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.698 |
| InChI Key: | ABYASLACMJENBP-UHFFFAOYSA-N |