5-(2,5-dimethylthiophen-3-yl)-1,3-dimethyl-6-(naphthalen-2-yl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Chemical Structure Depiction of
5-(2,5-dimethylthiophen-3-yl)-1,3-dimethyl-6-(naphthalen-2-yl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
5-(2,5-dimethylthiophen-3-yl)-1,3-dimethyl-6-(naphthalen-2-yl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Compound characteristics
| Compound ID: | J080-1107 |
| Compound Name: | 5-(2,5-dimethylthiophen-3-yl)-1,3-dimethyl-6-(naphthalen-2-yl)-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C24 H21 N3 O2 S |
| Smiles: | Cc1cc(c2c3C(N(C)C(N(C)c3[nH]c2c2ccc3ccccc3c2)=O)=O)c(C)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.7891 |
| logD: | 5.7891 |
| logSw: | -6.4216 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.233 |
| InChI Key: | XXZNPDCWGNQOTB-UHFFFAOYSA-N |