5-(2-bromophenyl)-6-butyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(2-bromophenyl)-6-butyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(2-bromophenyl)-6-butyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D252-0130 |
| Compound Name: | 5-(2-bromophenyl)-6-butyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 390.28 |
| Molecular Formula: | C18 H20 Br N3 O2 |
| Smiles: | CCCCn1cc2c(C(N(C)C(N2C)=O)=O)c1c1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.6126 |
| logD: | 3.6126 |
| logSw: | -3.8823 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.578 |
| InChI Key: | SAFVEUAXPIZZNV-UHFFFAOYSA-N |