12-(2-chloro-5-nitrophenyl)-9,9-dimethyl-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Chemical Structure Depiction of
12-(2-chloro-5-nitrophenyl)-9,9-dimethyl-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
12-(2-chloro-5-nitrophenyl)-9,9-dimethyl-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Compound characteristics
| Compound ID: | 3004-4869 |
| Compound Name: | 12-(2-chloro-5-nitrophenyl)-9,9-dimethyl-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one |
| Molecular Weight: | 432.91 |
| Molecular Formula: | C25 H21 Cl N2 O3 |
| Smiles: | CC1(C)CC2=C(C(c3cc(ccc3[Cl])[N+]([O-])=O)c3c(ccc4ccccc34)N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4558 |
| logD: | 6.4511 |
| logSw: | -6.4286 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.38 |
| InChI Key: | IRAFJWCEGJOZKT-QHCPKHFHSA-N |