6-(4-bromophenyl)-5-(4-methoxyphenyl)-1-methyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Chemical Structure Depiction of
6-(4-bromophenyl)-5-(4-methoxyphenyl)-1-methyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
6-(4-bromophenyl)-5-(4-methoxyphenyl)-1-methyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Compound characteristics
| Compound ID: | J080-0453 |
| Compound Name: | 6-(4-bromophenyl)-5-(4-methoxyphenyl)-1-methyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione |
| Molecular Weight: | 426.27 |
| Molecular Formula: | C20 H16 Br N3 O3 |
| Smiles: | CN1C(NC(c2c(c3ccc(cc3)OC)c(c3ccc(cc3)[Br])[nH]c12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5662 |
| logD: | 4.5662 |
| logSw: | -4.6059 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.944 |
| InChI Key: | KQTDINFCJDINFW-UHFFFAOYSA-N |