927611-22-1
1H-1,4-DIAZEPINE-1-ACETAMIDE, HEXAHYDRO-N-[2-(1-METHYLETHYL)PHENYL]-4-(PHENYLMETHYL)-
Name1H-1,4-DIAZEPINE-1-ACETAMIDE, HEXAHYDRO-N-[2-(1-METHYLETHYL)PHENYL]-4-(PHENYLMETHYL)-
1Identification
【Name】
1H-1,4-DIAZEPINE-1-ACETAMIDE, HEXAHYDRO-N-[2-(1-METHYLETHYL)PHENYL]-4-(PHENYLMETHYL)-
【CAS】
【MDL】
MFCD09151967
【EnglishSynonyms】
【pro_formula】
C23 H31 N3 O
【pro_molWeight】
365.518
【Inchi】
InChI=1S/C23H31N3O/c1-19(2)21-11-6-7-12-22(21)24-23(27)18-26-14-8-13-25(15-16-26)17-20-9-4-3-5-10-20/h3-7,9-12,19H,8,13-18H2,1-2H3,(H,24,27)
【InChIKey】
InChIKey=YFFVTHMHIBLYJB-UHFFFAOYSA-N
【SMILES】
CC(C)c1ccccc1NC(=O)CN2CCCN(CC2)Cc3ccccc3
【MOL File】
1H-1,4-DIAZEPINE-1-A….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1H-1,4-DIAZEPINE-1-ACETAMIDE, HEXAHYDRO-N-[2-(1-METHYLETHYL)PHENYL]-4-(PHENYLMETHYL)-.cml