5-(4-chlorophenyl)-3-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 4-chlorobenzoate
Chemical Structure Depiction of
5-(4-chlorophenyl)-3-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 4-chlorobenzoate
5-(4-chlorophenyl)-3-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 4-chlorobenzoate
Compound characteristics
| Compound ID: | IB05-7178 |
| Compound Name: | 5-(4-chlorophenyl)-3-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 4-chlorobenzoate |
| Molecular Weight: | 529.43 |
| Molecular Formula: | C29 H22 Cl2 N4 O2 |
| Smiles: | CC(C)Cn1cc(c2c1nc(c1ccc(cc1)[Cl])n1c3ccccc3nc12)OC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 8.08 |
| logD: | 8.07 |
| logSw: | -7.64 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.43 |
| InChI Key: | XIMQROQDHGSODC-UHFFFAOYSA-N |