200,000+ products from a single source!
sales@angenechem.com
1316214-61-5 | 5-Pyrimidinecarboxamide, 2-[(2,6-dimethylphenyl)amino]-N-[7-(hydroxyamino)-7-oxoheptyl]-N-methyl-
CAS No: 1316214-61-5 Catalog No: AG000ZIM MDL No:
Product Description
Catalog Number:
AG000ZIM
Chemical Name:
5-Pyrimidinecarboxamide, 2-[(2,6-dimethylphenyl)amino]-N-[7-(hydroxyamino)-7-oxoheptyl]-N-methyl-
CAS Number:
1316214-61-5
Molecular Formula:
C21H29N5O3
Molecular Weight:
399.4867
IUPAC Name:
2-(2,6-dimethylanilino)-N-[7-(hydroxyamino)-7-oxoheptyl]pyrimidine-5-carboxamide
InChI:
InChI=1S/C20H27N5O3/c1-14-8-7-9-15(2)18(14)24-20-22-12-16(13-23-20)19(27)21-11-6-4-3-5-10-17(26)25-28/h7-9,12-13,28H,3-6,10-11H2,1-2H3,(H,21,27)(H,25,26)(H,22,23,24)
InChI Key:
KPEBNCNUUOASPJ-UHFFFAOYSA-N
SMILES:
ONC(=O)CCCCCCN(C(=O)c1cnc(nc1)Nc1c(C)cccc1C)C
Properties
Complexity:
473
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.211g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
385.468g/mol
Monoisotopic Mass:
385.211g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.