927611-12-9
1H-1,4-DIAZEPINE-1-ACETAMIDE, N-(2-ETHOXYPHENYL)HEXAHYDRO-4-(PHENYLMETHYL)-
Name1H-1,4-DIAZEPINE-1-ACETAMIDE, N-(2-ETHOXYPHENYL)HEXAHYDRO-4-(PHENYLMETHYL)-
1Identification
【Name】
1H-1,4-DIAZEPINE-1-ACETAMIDE, N-(2-ETHOXYPHENYL)HEXAHYDRO-4-(PHENYLMETHYL)-
【CAS】
【MDL】
MFCD09151952
【EnglishSynonyms】
【pro_formula】
C22 H29 N3 O2
【pro_molWeight】
367.49
【Inchi】
InChI=1S/C22H29N3O2/c1-2-27-21-12-7-6-11-20(21)23-22(26)18-25-14-8-13-24(15-16-25)17-19-9-4-3-5-10-19/h3-7,9-12H,2,8,13-18H2,1H3,(H,23,26)
【InChIKey】
InChIKey=YIBOEASZCYOBKL-UHFFFAOYSA-N
【SMILES】
CCOc1ccccc1NC(=O)CN2CCCN(CC2)Cc3ccccc3
【MOL File】
1H-1,4-DIAZEPINE-1-A….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1H-1,4-DIAZEPINE-1-ACETAMIDE, N-(2-ETHOXYPHENYL)HEXAHYDRO-4-(PHENYLMETHYL)-.cml