ethyl 2-[(2,5-dimethyl-4-{methyl[4-(propan-2-yl)phenyl]amino}thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 2-[(2,5-dimethyl-4-{methyl[4-(propan-2-yl)phenyl]amino}thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate
ethyl 2-[(2,5-dimethyl-4-{methyl[4-(propan-2-yl)phenyl]amino}thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K937-0335 |
| Compound Name: | ethyl 2-[(2,5-dimethyl-4-{methyl[4-(propan-2-yl)phenyl]amino}thieno[2,3-d]pyrimidine-6-carbonyl)amino]benzoate |
| Molecular Weight: | 502.64 |
| Molecular Formula: | C28 H30 N4 O3 S |
| Smiles: | CCOC(c1ccccc1NC(c1c(C)c2c(nc(C)nc2s1)N(C)c1ccc(cc1)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7689 |
| logD: | 6.042 |
| logSw: | -5.9672 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.78 |
| InChI Key: | QXOFITMRVXEHLR-UHFFFAOYSA-N |