Name: Name:2-Propenoic acid, 3-[4-(aminocarbonyl)-2,6-dimethylphenyl]-2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (2Z)-
Brand: Angene
SKU: AG00GU7T
Rating: 90 (10 reviews)

2-Propenoic acid, 3-[4-(aminocarbonyl)-2,6-dimethylphenyl]-2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (2Z)-

CAS No.:

864825-84-3

Catalog Number:

AG00GU7T

Molecular Formula:

C18H24N2O5

Molecular Weight:

348.3936

Catalog Number:

AG00GU7T

Chemical Name:

2-Propenoic acid, 3-[4-(aminocarbonyl)-2,6-dimethylphenyl]-2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (2Z)-

CAS Number:

864825-84-3

Molecular Formula:

C18H24N2O5

Molecular Weight:

348.3936

MDL Number:

MFCD29472312

IUPAC Name:

methyl (Z)-3-(4-carbamoyl-2,6-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]prop-2-enoate

InChI:

InChI=1S/C18H24N2O5/c1-10-7-12(15(19)21)8-11(2)13(10)9-14(16(22)24-6)20-17(23)25-18(3,4)5/h7-9H,1-6H3,(H2,19,21)(H,20,23)/b14-9-

InChI Key:

JTRKHURHLHATAD-ZROIWOOFSA-N

SMILES:

COC(=O)/C(=C/c1c(C)cc(cc1C)C(=O)N)/NC(=O)OC(C)(C)C

Complexity:

538

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

348.169g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

348.399g/mol

Monoisotopic Mass:

348.169g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

108A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6