7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
					Chemical Structure Depiction of
7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
			7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | A0061171 | 
| Compound Name: | 7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one | 
| Molecular Weight: | 457.55 | 
| Molecular Formula: | C26 H23 N3 O3 S | 
| Smiles: | COc1ccc(CN2C(c3ccc(cc3NC2=S)C(N2CCc3ccccc3C2)=O)=O)cc1 | 
| Stereo: | ACHIRAL | 
| logP: | 4.2587 | 
| logD: | 4.2585 | 
| logSw: | -4.1996 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 51.172 | 
| InChI Key: | MMRNVWIJCVJTKC-UHFFFAOYSA-N | 
 
				 
				