4-[4,4-bis(4-methylphenyl)-1,4-dihydro-2H-3,1-benzoxazin-2-yl]-N,N-dimethyl-2-nitroaniline
Chemical Structure Depiction of
4-[4,4-bis(4-methylphenyl)-1,4-dihydro-2H-3,1-benzoxazin-2-yl]-N,N-dimethyl-2-nitroaniline
4-[4,4-bis(4-methylphenyl)-1,4-dihydro-2H-3,1-benzoxazin-2-yl]-N,N-dimethyl-2-nitroaniline
Compound characteristics
| Compound ID: | 8018-3627 |
| Compound Name: | 4-[4,4-bis(4-methylphenyl)-1,4-dihydro-2H-3,1-benzoxazin-2-yl]-N,N-dimethyl-2-nitroaniline |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C30 H29 N3 O3 |
| Smiles: | Cc1ccc(cc1)C1(c2ccc(C)cc2)c2ccccc2NC(c2ccc(c(c2)[N+]([O-])=O)N(C)C)O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5461 |
| logD: | 7.5461 |
| logSw: | -5.8011 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.846 |
| InChI Key: | GRXFOBRWPNBELO-LJAQVGFWSA-N |