ethyl 2-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
					Chemical Structure Depiction of
ethyl 2-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
			ethyl 2-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | D053-0232 | 
| Compound Name: | ethyl 2-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate | 
| Molecular Weight: | 443.93 | 
| Molecular Formula: | C17 H18 Cl N3 O5 S2 | 
| Smiles: | [H]N(C(c1c(cnc(n1)S(C)(=O)=O)[Cl])=O)c1c(C(=O)OCC)c2CCCCc2s1 | 
| Stereo: | ACHIRAL | 
| logP: | 2.7886 | 
| logD: | -3.1646 | 
| logSw: | -3.7493 | 
| Hydrogen bond acceptors count: | 11 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 92.96 | 
| InChI Key: | ZSWSTWFQKGXRGH-UHFFFAOYSA-N | 
 
				 
				