Name: Name:3,5-dinitro-N-(pyridin-3-ylmethyl)benzamide
Brand: Angene
SKU: AG01ACVQ
Rating: 90 (10 reviews)

3,5-dinitro-N-(pyridin-3-ylmethyl)benzamide

CAS No.:

58624-47-8

Catalog Number:

AG01ACVQ

Molecular Formula:

C13H10N4O5

Molecular Weight:

302.2423

Catalog Number:

AG01ACVQ

Chemical Name:

3,5-dinitro-N-(pyridin-3-ylmethyl)benzamide

CAS Number:

58624-47-8

Molecular Formula:

C13H10N4O5

Molecular Weight:

302.2423

MDL Number:

MFCD00495413

IUPAC Name:

3,5-dinitro-N-(pyridin-3-ylmethyl)benzamide

InChI:

InChI=1S/C13H10N4O5/c18-13(15-8-9-2-1-3-14-7-9)10-4-11(16(19)20)6-12(5-10)17(21)22/h1-7H,8H2,(H,15,18)

InChI Key:

FJCYLVQFDZVCHN-UHFFFAOYSA-N

SMILES:

O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])NCc1cccnc1

Complexity:

411

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

302.065g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

302.246g/mol

Monoisotopic Mass:

302.065g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

134A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3