Name: Name:1-(1,4-diazepan-1-yl)-3-(4-methoxyphenyl)propan-1-one
Brand: Angene
SKU: AG01A8QP
Rating: 90 (10 reviews)

1-(1,4-diazepan-1-yl)-3-(4-methoxyphenyl)propan-1-one

CAS No.:

1016684-28-8

Catalog Number:

AG01A8QP

Molecular Formula:

C15H22N2O2

Molecular Weight:

262.3474

Catalog Number:

AG01A8QP

Chemical Name:

1-(1,4-diazepan-1-yl)-3-(4-methoxyphenyl)propan-1-one

CAS Number:

1016684-28-8

Molecular Formula:

C15H22N2O2

Molecular Weight:

262.3474

MDL Number:

MFCD09817016

IUPAC Name:

1-(1,4-diazepan-1-yl)-3-(4-methoxyphenyl)propan-1-one

InChI:

InChI=1S/C15H22N2O2/c1-19-14-6-3-13(4-7-14)5-8-15(18)17-11-2-9-16-10-12-17/h3-4,6-7,16H,2,5,8-12H2,1H3

InChI Key:

LWZMXXWBUPTQIN-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)CCC(=O)N1CCNCCC1

Complexity:

275

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

262.168g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

262.353g/mol

Monoisotopic Mass:

262.168g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3