2-[2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
2-[2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D163-0821 |
| Compound Name: | 2-[2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 466.5 |
| Molecular Formula: | C27 H22 N4 O4 |
| Smiles: | Cc1c(/C=C/C2=Nc3ccccc3C(N2c2ccc(cc2)[N+]([O-])=O)=O)c2cc(ccc2n1C)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2366 |
| logD: | 4.2351 |
| logSw: | -4.5224 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.802 |
| InChI Key: | RMDQHEFRILNCBC-UHFFFAOYSA-N |