3-(3-chloro-4-methoxyphenyl)-5-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-5-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
3-(3-chloro-4-methoxyphenyl)-5-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Compound characteristics
| Compound ID: | C507-0046 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-5-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one |
| Molecular Weight: | 573.01 |
| Molecular Formula: | C29 H25 Cl N6 O5 |
| Smiles: | Cn1c2C(N(c3ccc(c(c3)[Cl])OC)N=C(C(N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4328 |
| logD: | 4.4328 |
| logSw: | -4.8904 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.891 |
| InChI Key: | RYICTMQFKPGXHB-UHFFFAOYSA-N |