Name: Name:4-chloro-2-[3-(4H-1,2,4-triazol-3-yl)-1,2,4-oxadiazol-5-yl]phenol
Brand: Angene
SKU: AG01A6MM
Rating: 90 (10 reviews)

4-chloro-2-[3-(4H-1,2,4-triazol-3-yl)-1,2,4-oxadiazol-5-yl]phenol

CAS No.:

1461713-53-0

Catalog Number:

AG01A6MM

Molecular Formula:

C10H6ClN5O2

Molecular Weight:

263.6399

Catalog Number:

AG01A6MM

Chemical Name:

4-chloro-2-[3-(4H-1,2,4-triazol-3-yl)-1,2,4-oxadiazol-5-yl]phenol

CAS Number:

1461713-53-0

Molecular Formula:

C10H6ClN5O2

Molecular Weight:

263.6399

MDL Number:

MFCD18627878

IUPAC Name:

4-chloro-2-[3-(1H-1,2,4-triazol-5-yl)-1,2,4-oxadiazol-5-yl]phenol

InChI:

InChI=1S/C10H6ClN5O2/c11-5-1-2-7(17)6(3-5)10-14-9(16-18-10)8-12-4-13-15-8/h1-4,17H,(H,12,13,15)

InChI Key:

XPVORZGETZRKFH-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)c1onc(n1)c1nnc[nH]1)O

Complexity:

297

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.021g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

263.641g/mol

Monoisotopic Mass:

263.021g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8