N-(2-methoxy-5-nitrophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
N-(2-methoxy-5-nitrophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K913-0093 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 534.59 |
| Molecular Formula: | C26 H26 N6 O5 S |
| Smiles: | Cc1c2c(ncnc2sc1C(Nc1cc(ccc1OC)[N+]([O-])=O)=O)N1CCN(CC1)c1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.9984 |
| logD: | 4.1368 |
| logSw: | -4.8728 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.534 |
| InChI Key: | AJQYJKUPNGBMME-UHFFFAOYSA-N |