N-[(3-chlorophenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
N-[(3-chlorophenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G394-0200 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 415.94 |
| Molecular Formula: | C20 H22 Cl N5 O S |
| Smiles: | Cc1c2c(ncnc2sc1C(NCc1cccc(c1)[Cl])=O)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.8853 |
| logD: | 3.4208 |
| logSw: | -4.2958 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.428 |
| InChI Key: | NGSOVLJOIRHCAT-UHFFFAOYSA-N |