methyl 2-[(6,8-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
					Chemical Structure Depiction of
methyl 2-[(6,8-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
			methyl 2-[(6,8-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | D103-1689 | 
| Compound Name: | methyl 2-[(6,8-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate | 
| Molecular Weight: | 411.48 | 
| Molecular Formula: | C22 H21 N O5 S | 
| Smiles: | [H]N(C(C1=CC(c2cc(C)cc(C)c2O1)=O)=O)c1c(C(=O)OC)c2CCCCc2s1 | 
| Stereo: | ACHIRAL | 
| logP: | 4.8058 | 
| logD: | 1.5587 | 
| logSw: | -4.6479 | 
| Hydrogen bond acceptors count: | 8 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 65.721 | 
| InChI Key: | MLENCHYTOHXNEE-UHFFFAOYSA-N | 
 
				 
				