200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 132828-63-8
132828-63-8 | 4-Imidazolidinone, 5-[(3,4-dihydroxyphenyl)methyl]-3-phenyl-2-thioxo-, (S)- (9CI)
CAS No: 132828-63-8 Catalog No: AG00118I MDL No:
Product Description
Catalog Number:
AG00118I
Chemical Name:
4-Imidazolidinone, 5-[(3,4-dihydroxyphenyl)methyl]-3-phenyl-2-thioxo-, (S)- (9CI)
CAS Number:
132828-63-8
Molecular Formula:
C16H14N2O3S
Molecular Weight:
314.3590
IUPAC Name:
(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid;1-phenyl-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C9H8N2OS.C9H11NO4/c12-8-6-11(9(13)10-8)7-4-2-1-3-5-7;10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-5H,6H2,(H,10,12,13);1-2,4,6,11-12H,3,10H2,(H,13,14)/t;6-/m.0/s1
InChI Key:
QPUDLQBQQZBJLY-ZCMDIHMWSA-N
SMILES:
S=C1N[C@H](C(=O)N1c1ccccc1)Cc1ccc(c(c1)O)O
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
389.105g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
389.426g/mol
Monoisotopic Mass:
389.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
168A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.