Name: Name:Carbamic acid, N-[4-[4-(dimethylamino)-1-piperidinyl]-2-methoxy-5-[(1-oxo-2-propen-1-yl)amino]phenyl]-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG002DN3
Rating: 90 (10 reviews)

Carbamic acid, N-[4-[4-(dimethylamino)-1-piperidinyl]-2-methoxy-5-[(1-oxo-2-propen-1-yl)amino]phenyl]-, 1,1-dimethylethyl ester

CAS No.:

1894234-36-6

Catalog Number:

AG002DN3

Molecular Formula:

C22H34N4O4

Molecular Weight:

418.5298

Catalog Number:

AG002DN3

Chemical Name:

Carbamic acid, N-[4-[4-(dimethylamino)-1-piperidinyl]-2-methoxy-5-[(1-oxo-2-propen-1-yl)amino]phenyl]-, 1,1-dimethylethyl ester

CAS Number:

1894234-36-6

Molecular Formula:

C22H34N4O4

Molecular Weight:

418.5298

MDL Number:

MFCD30471687

IUPAC Name:

tert-butyl N-[4-[4-(dimethylamino)piperidin-1-yl]-2-methoxy-5-(prop-2-enoylamino)phenyl]carbamate

InChI:

InChI=1S/C22H34N4O4/c1-8-20(27)23-16-13-17(24-21(28)30-22(2,3)4)19(29-7)14-18(16)26-11-9-15(10-12-26)25(5)6/h8,13-15H,1,9-12H2,2-7H3,(H,23,27)(H,24,28)

InChI Key:

FKHBXDRZYHNBLX-UHFFFAOYSA-N

SMILES:

C=CC(=O)Nc1cc(NC(=O)OC(C)(C)C)c(cc1N1CCC(CC1)N(C)C)OC

Complexity:

596

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

418.258g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

418.538g/mol

Monoisotopic Mass:

418.258g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9