N-[2-(2,4-dimethoxyphenyl)ethyl]-4-[(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)methyl]benzamide
					Chemical Structure Depiction of
N-[2-(2,4-dimethoxyphenyl)ethyl]-4-[(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)methyl]benzamide
			N-[2-(2,4-dimethoxyphenyl)ethyl]-4-[(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | C200-2857 | 
| Compound Name: | N-[2-(2,4-dimethoxyphenyl)ethyl]-4-[(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)methyl]benzamide | 
| Molecular Weight: | 544.63 | 
| Molecular Formula: | C29 H28 N4 O5 S | 
| Smiles: | COc1ccc(CCNC(c2ccc(CN3C(c4c(c5cc(ccc5[nH]4)OC)NC3=S)=O)cc2)=O)c(c1)OC | 
| Stereo: | ACHIRAL | 
| logP: | 3.9294 | 
| logD: | 3.9294 | 
| logSw: | -4.2438 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 3 | 
| Polar surface area: | 82.249 | 
| InChI Key: | LECHKKVUWCRFJL-UHFFFAOYSA-N | 
 
				 
				