4-[({2-[cyclohexyl(methyl)amino]-5-nitrophenyl}methylidene)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[({2-[cyclohexyl(methyl)amino]-5-nitrophenyl}methylidene)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-[({2-[cyclohexyl(methyl)amino]-5-nitrophenyl}methylidene)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8005-8746 |
| Compound Name: | 4-[({2-[cyclohexyl(methyl)amino]-5-nitrophenyl}methylidene)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 447.54 |
| Molecular Formula: | C25 H29 N5 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)/N=C/c1cc(ccc1N(C)C1CCCCC1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1317 |
| logD: | 4.1317 |
| logSw: | -4.2305 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.834 |
| InChI Key: | IVDHWBWPVMSZQA-UHFFFAOYSA-N |