4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidine
Chemical Structure Depiction of
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidine
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V027-8990 |
| Compound Name: | 4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidine |
| Molecular Weight: | 508.02 |
| Molecular Formula: | C21 H22 Cl N5 O4 S2 |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(C3CC3)nc2sc1C)N1CCN(CC1)S(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5752 |
| logD: | 3.2525 |
| logSw: | -6.0017 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.151 |
| InChI Key: | MVAIRCAKNMYBLV-UHFFFAOYSA-N |