methyl 3-[(2-{[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]amino}ethyl)sulfamoyl]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(2-{[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]amino}ethyl)sulfamoyl]thiophene-2-carboxylate
methyl 3-[(2-{[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]amino}ethyl)sulfamoyl]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | V027-2764 |
| Compound Name: | methyl 3-[(2-{[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]amino}ethyl)sulfamoyl]thiophene-2-carboxylate |
| Molecular Weight: | 520.99 |
| Molecular Formula: | C22 H18 Cl F N4 O4 S2 |
| Salt: | not_available |
| Smiles: | COC(c1c(ccs1)S(NCCNc1c2ccc(cc2nc(c2ccc(cc2)F)n1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7701 |
| logD: | 5.6708 |
| logSw: | -6.1131 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.032 |
| InChI Key: | YXMQATFROUKEMU-UHFFFAOYSA-N |