200,000+ products from a single source!
sales@angenechem.com
138312-45-5 | L-Alaninamide, L-phenylalanyl-N-(5-amino-7-chloro-6-oxoheptyl)- (9CI)
CAS No: 138312-45-5 Catalog No: AG0018JB MDL No:
Product Description
Catalog Number:
AG0018JB
Chemical Name:
L-Alaninamide, L-phenylalanyl-N-(5-amino-7-chloro-6-oxoheptyl)- (9CI)
CAS Number:
138312-45-5
Molecular Formula:
C19H29ClN4O3
Molecular Weight:
396.9116
IUPAC Name:
2-amino-N-[1-[(5-amino-7-chloro-6-oxoheptyl)amino]-1-oxopropan-2-yl]-3-phenylpropanamide
InChI:
InChI=1S/C19H29ClN4O3/c1-13(18(26)23-10-6-5-9-15(21)17(25)12-20)24-19(27)16(22)11-14-7-3-2-4-8-14/h2-4,7-8,13,15-16H,5-6,9-12,21-22H2,1H3,(H,23,26)(H,24,27)
InChI Key:
WVUXUFGBIPKZOF-UHFFFAOYSA-N
SMILES:
ClCC(=O)C(CCCCNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)N)C)N
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.193g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
396.916g/mol
Monoisotopic Mass:
396.193g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.