Name: Name:5-(2-Methyl-4-nitrophenyl)-furan-2-carboxylic acid [3-(5,7-dimethylbenzooxazol-2-yl)phenyl]amide
Brand: Angene
SKU: AG01F2BA
Rating: 90 (10 reviews)

5-(2-Methyl-4-nitrophenyl)-furan-2-carboxylic acid [3-(5,7-dimethylbenzooxazol-2-yl)phenyl]amide

CAS No.:

328975-78-6

Catalog Number:

AG01F2BA

Molecular Formula:

C27H21N3O5

Molecular Weight:

467.4727

Catalog Number:

AG01F2BA

Chemical Name:

5-(2-Methyl-4-nitrophenyl)-furan-2-carboxylic acid [3-(5,7-dimethylbenzooxazol-2-yl)phenyl]amide

CAS Number:

328975-78-6

Molecular Formula:

C27H21N3O5

Molecular Weight:

467.4727

MDL Number:

MFCD01784954

IUPAC Name:

N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-(2-methyl-4-nitrophenyl)furan-2-carboxamide

InChI:

InChI=1S/C27H21N3O5/c1-15-11-17(3)25-22(12-15)29-27(35-25)18-5-4-6-19(14-18)28-26(31)24-10-9-23(34-24)21-8-7-20(30(32)33)13-16(21)2/h4-14H,1-3H3,(H,28,31)

InChI Key:

ANBKEEHZKDWEDU-UHFFFAOYSA-N

SMILES:

Cc1cc(C)c2c(c1)nc(o2)c1cccc(c1)NC(=O)c1ccc(o1)c1ccc(cc1C)[N+](=O)[O-]

Complexity:

774

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

467.148g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

467.481g/mol

Monoisotopic Mass:

467.148g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

114A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.2