1,3-dimethyl-6-(4-methylbenzene-1-sulfonyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
1,3-dimethyl-6-(4-methylbenzene-1-sulfonyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,6H)-dione
1,3-dimethyl-6-(4-methylbenzene-1-sulfonyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | C066-5548 |
| Compound Name: | 1,3-dimethyl-6-(4-methylbenzene-1-sulfonyl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 333.36 |
| Molecular Formula: | C15 H15 N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(C1C=C2C(=N1)N(C)C(N(C)C2=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6044 |
| logD: | 1.6044 |
| logSw: | -2.361 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.918 |
| InChI Key: | HZZBUGXLXIXWNW-LBPRGKRZSA-N |