200,000+ products from a single source!
sales@angenechem.com
1251577-69-1 | 5-(4-(Isopropylsulfonyl)benzyl)-1,3,4-oxadiazol-2-amine
CAS No: 1251577-69-1 Catalog No: AG01FMEC MDL No:MFCD22587575
Product Description
Catalog Number:
AG01FMEC
Chemical Name:
5-(4-(Isopropylsulfonyl)benzyl)-1,3,4-oxadiazol-2-amine
CAS Number:
1251577-69-1
Molecular Formula:
C12H15N3O3S
Molecular Weight:
281.3308
MDL Number:
MFCD22587575
IUPAC Name:
5-[(4-propan-2-ylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C12H15N3O3S/c1-8(2)19(16,17)10-5-3-9(4-6-10)7-11-14-15-12(13)18-11/h3-6,8H,7H2,1-2H3,(H2,13,15)
InChI Key:
DNMKJXWJUVMLLH-UHFFFAOYSA-N
SMILES:
Nc1nnc(o1)Cc1ccc(cc1)S(=O)(=O)C(C)C
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.083g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.33g/mol
Monoisotopic Mass:
281.083g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.