methyl N-[(5-bromo-1H-indol-1-yl)acetyl]-beta-alaninate
					Chemical Structure Depiction of
methyl N-[(5-bromo-1H-indol-1-yl)acetyl]-beta-alaninate
			methyl N-[(5-bromo-1H-indol-1-yl)acetyl]-beta-alaninate
Compound characteristics
| Compound ID: | Y041-4270 | 
| Compound Name: | methyl N-[(5-bromo-1H-indol-1-yl)acetyl]-beta-alaninate | 
| Molecular Weight: | 339.19 | 
| Molecular Formula: | C14 H15 Br N2 O3 | 
| Smiles: | COC(CCNC(Cn1ccc2cc(ccc12)[Br])=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 1.9163 | 
| logD: | 1.9163 | 
| logSw: | -2.8145 | 
| Hydrogen bond acceptors count: | 5 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 47.241 | 
| InChI Key: | HUIIFCNDBLMPCC-UHFFFAOYSA-N | 
 
				 
				