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303162-60-9 | Benzamide, N-[4-[2-amino-4-(4-methoxyphenyl)-5-thiazolyl]-2-pyridinyl]-
CAS No: 303162-60-9 Catalog No: AG002ZP3 MDL No:
Product Description
Catalog Number:
AG002ZP3
Chemical Name:
Benzamide, N-[4-[2-amino-4-(4-methoxyphenyl)-5-thiazolyl]-2-pyridinyl]-
CAS Number:
303162-60-9
Molecular Formula:
C22H18N4O2S
Molecular Weight:
402.4689
IUPAC Name:
N-[4-[2-amino-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]pyridin-2-yl]benzamide
InChI:
InChI=1S/C22H18N4O2S/c1-28-17-9-7-14(8-10-17)19-20(29-22(23)26-19)16-11-12-24-18(13-16)25-21(27)15-5-3-2-4-6-15/h2-13H,1H3,(H2,23,26)(H,24,25,27)
InChI Key:
LKSQZAFLOMNABA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc(sc1c1ccnc(c1)NC(=O)c1ccccc1)N
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.115g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
402.472g/mol
Monoisotopic Mass:
402.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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