AC1MHZ5W

oxalic acid;N-phenyl-N-[2-(3-propan-2-yl-1,3-diazinan-1-yl)ethyl]propanamide

Also Known As: C18H29N3O.2C2H2O4.1/2H2O|N-(2-(3-Isopropylhexahydropyrimidino)ethyl)propionanilide oxalate hydrate|Propanamide, N-phenyl-N-(2-(tetrahydro-3-(1-methylethyl)-1(2H)-pyrimidinyl)ethyl)-, ethanedioate, hydrate (2:4:1)|C18-H29-N3-O.2C2-H2-O4.1/2H2-O|Oxalic acid--N-phenyl-N-{2-[3-(propan-2-yl)-1,3-diazinan-1-yl]ethyl}propanamide (2/1)|oxalic acid; N-phenyl-N-[2-(3-propan-2-yl-1,3-diazinan-1-yl)ethyl]propanamide

Molecular Formula	C22H33N3O9
Molecular Weight	483.22168 g/mol
LogP	1.1144
Topological Polar Surface Area	175.99 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	483.22168
Monoisotopic Mass	483.22168
Heavy Atoms	34
Complexity	767.0982

Chemical Identifiers

CAS Number	77869-75-1
SMILES	CCC(=O)N(CCN1CCCN(C1)C(C)C)C2=CC=CC=C2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O