Name: Name:5-[4-(Dimethylamino)phenyl]-4-(3-{[(4-methoxyphenyl)methyl]amino}propyl)-1,2-dihydropyrazol-3-one
Brand: Angene
SKU: AG00I37Y
Rating: 90 (10 reviews)

5-[4-(Dimethylamino)phenyl]-4-(3-{[(4-methoxyphenyl)methyl]amino}propyl)-1,2-dihydropyrazol-3-one

CAS No.:

1951440-88-2

Catalog Number:

AG00I37Y

Molecular Formula:

C22H28N4O2

Molecular Weight:

380.4833

Catalog Number:

AG00I37Y

Chemical Name:

5-[4-(Dimethylamino)phenyl]-4-(3-{[(4-methoxyphenyl)methyl]amino}propyl)-1,2-dihydropyrazol-3-one

CAS Number:

1951440-88-2

Molecular Formula:

C22H28N4O2

Molecular Weight:

380.4833

MDL Number:

MFCD29917483

IUPAC Name:

5-[4-(dimethylamino)phenyl]-4-[3-[(4-methoxyphenyl)methylamino]propyl]-1,2-dihydropyrazol-3-one

InChI:

InChI=1S/C22H28N4O2/c1-26(2)18-10-8-17(9-11-18)21-20(22(27)25-24-21)5-4-14-23-15-16-6-12-19(28-3)13-7-16/h6-13,23H,4-5,14-15H2,1-3H3,(H2,24,25,27)

InChI Key:

RNADXDKKJIZUCE-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)CNCCCc1c(=O)[nH][nH]c1c1ccc(cc1)N(C)C

Complexity:

533

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

380.221g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

380.492g/mol

Monoisotopic Mass:

380.221g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2