5-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(methanesulfonyl)pyrimidine-4-carboxamide
					Chemical Structure Depiction of
5-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(methanesulfonyl)pyrimidine-4-carboxamide
			5-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(methanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D053-0233 | 
| Compound Name: | 5-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(methanesulfonyl)pyrimidine-4-carboxamide | 
| Molecular Weight: | 396.87 | 
| Molecular Formula: | C15 H13 Cl N4 O3 S2 | 
| Smiles: | [H]N(C(c1c(cnc(n1)S(C)(=O)=O)[Cl])=O)c1c(C#N)c2CCCCc2s1 | 
| Stereo: | ACHIRAL | 
| logP: | 2.3263 | 
| logD: | -2.5969 | 
| logSw: | -3.4334 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 89.263 | 
| InChI Key: | OKLNXEXAZULSTJ-UHFFFAOYSA-N | 
 
				 
				