200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 1146289-98-6
1146289-98-6 | N-[(5-methylfuran-2-yl)methyl]-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-1-yl)benzamide
CAS No: 1146289-98-6 Catalog No: AG00HCVX MDL No:MFCD14703426
Product Description
Catalog Number:
AG00HCVX
Chemical Name:
N-[(5-methylfuran-2-yl)methyl]-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-1-yl)benzamide
CAS Number:
1146289-98-6
Molecular Formula:
C16H15N3O2S
Molecular Weight:
313.3742
MDL Number:
MFCD14703426
IUPAC Name:
N-[(5-methylfuran-2-yl)methyl]-3-(2-sulfanylidene-1H-imidazol-3-yl)benzamide
InChI:
InChI=1S/C16H15N3O2S/c1-11-5-6-14(21-11)10-18-15(20)12-3-2-4-13(9-12)19-8-7-17-16(19)22/h2-9H,10H2,1H3,(H,17,22)(H,18,20)
InChI Key:
BJSCGNFLIVSNAU-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)CNC(=O)c1cccc(c1)n1cc[nH]c1=S
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.088g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
313.375g/mol
Monoisotopic Mass:
313.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
© 2019 Angene International Limited. All rights Reserved.