Name: Name:1-(2,4-difluorophenyl)-5-methyl-1,4-diazepane dihydrochloride
Brand: Angene
SKU: AG01EJ7P
Rating: 90 (10 reviews)

1-(2,4-difluorophenyl)-5-methyl-1,4-diazepane dihydrochloride

CAS No.:

2126163-02-6

Catalog Number:

AG01EJ7P

Molecular Formula:

C12H18Cl2F2N2

Molecular Weight:

299.1875

Catalog Number:

AG01EJ7P

Chemical Name:

1-(2,4-difluorophenyl)-5-methyl-1,4-diazepane dihydrochloride

CAS Number:

2126163-02-6

Molecular Formula:

C12H18Cl2F2N2

Molecular Weight:

299.1875

MDL Number:

MFCD31381433

IUPAC Name:

1-(2,4-difluorophenyl)-5-methyl-1,4-diazepane;dihydrochloride

InChI:

InChI=1S/C12H16F2N2.2ClH/c1-9-4-6-16(7-5-15-9)12-3-2-10(13)8-11(12)14;;/h2-3,8-9,15H,4-7H2,1H3;2*1H

InChI Key:

XLQIIARQBVFIHK-UHFFFAOYSA-N

SMILES:

CC1NCCN(CC1)c1ccc(cc1F)F.Cl.Cl

Complexity:

225

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

298.082g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.187g/mol

Monoisotopic Mass:

298.082g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

15.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: