5-(2-bromophenyl)-1,3-dimethyl-6-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(2-bromophenyl)-1,3-dimethyl-6-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(2-bromophenyl)-1,3-dimethyl-6-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D252-0125 |
| Compound Name: | 5-(2-bromophenyl)-1,3-dimethyl-6-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 466.29 |
| Molecular Formula: | C21 H16 Br N5 O3 |
| Smiles: | CN1C(c2c(cn(c3ccc4c(c3)NC(N4)=O)c2c2ccccc2[Br])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0465 |
| logD: | 3.0465 |
| logSw: | -3.6146 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.514 |
| InChI Key: | STXQJZDTPPGNPD-UHFFFAOYSA-N |