methyl 3-{[5-methyl-4-(morpholin-4-yl)thieno[3,4-d]pyrimidine-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[5-methyl-4-(morpholin-4-yl)thieno[3,4-d]pyrimidine-2-carbonyl]amino}benzoate
methyl 3-{[5-methyl-4-(morpholin-4-yl)thieno[3,4-d]pyrimidine-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | T480-0520 |
| Compound Name: | methyl 3-{[5-methyl-4-(morpholin-4-yl)thieno[3,4-d]pyrimidine-2-carbonyl]amino}benzoate |
| Molecular Weight: | 412.47 |
| Molecular Formula: | C20 H20 N4 O4 S |
| Smiles: | Cc1c2c(nc(C(Nc3cccc(c3)C(=O)OC)=O)nc2cs1)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.8681 |
| logD: | 3.868 |
| logSw: | -4.1673 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.102 |
| InChI Key: | XTBODALDGYUCFS-UHFFFAOYSA-N |