Name: Name:2-Pyridinecarboxylic acid, 4-[(1-cyclobutyl-4,5,6,7,8,9-hexahydro-4-oxo-3H-pyrazolo[3,4-c]quinolin-3-yl)methyl]-, methyl ester
Brand: Angene
SKU: AG001DZK
Rating: 90 (10 reviews)

2-Pyridinecarboxylic acid, 4-[(1-cyclobutyl-4,5,6,7,8,9-hexahydro-4-oxo-3H-pyrazolo[3,4-c]quinolin-3-yl)methyl]-, methyl ester

CAS No.:

1464091-45-9

Catalog Number:

AG001DZK

Molecular Formula:

C22H24N4O3

Molecular Weight:

392.4510

Catalog Number:

AG001DZK

Chemical Name:

2-Pyridinecarboxylic acid, 4-[(1-cyclobutyl-4,5,6,7,8,9-hexahydro-4-oxo-3H-pyrazolo[3,4-c]quinolin-3-yl)methyl]-, methyl ester

CAS Number:

1464091-45-9

Molecular Formula:

C22H24N4O3

Molecular Weight:

392.4510

MDL Number:

MFCD26406740

IUPAC Name:

methyl 4-[(1-cyclobutyl-4-oxo-6,7,8,9-tetrahydro-5H-pyrazolo[3,4-c]quinolin-3-yl)methyl]pyridine-2-carboxylate

InChI:

InChI=1S/C22H24N4O3/c1-29-22(28)17-11-13(9-10-23-17)12-26-20-18(19(25-26)14-5-4-6-14)15-7-2-3-8-16(15)24-21(20)27/h9-11,14H,2-8,12H2,1H3,(H,24,27)

InChI Key:

FVGFNGWVMYIEQQ-UHFFFAOYSA-N

SMILES:

COC(=O)c1nccc(c1)Cn1nc(c2c1c(=O)[nH]c1c2CCCC1)C1CCC1

Complexity:

704

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

392.185g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

392.459g/mol

Monoisotopic Mass:

392.185g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6