Name: Name:2-(piperazin-1-yl)-3H,4H,5H,6H,7H,8H,9H-cyclohepta[d]pyrimidin-4-one dihydrochloride
Brand: Angene
SKU: AG01EHVL
Rating: 90 (10 reviews)

2-(piperazin-1-yl)-3H,4H,5H,6H,7H,8H,9H-cyclohepta[d]pyrimidin-4-one dihydrochloride

CAS No.:

2137960-05-3

Catalog Number:

AG01EHVL

Molecular Formula:

C13H22Cl2N4O

Molecular Weight:

321.2460

Catalog Number:

AG01EHVL

Chemical Name:

2-(piperazin-1-yl)-3H,4H,5H,6H,7H,8H,9H-cyclohepta[d]pyrimidin-4-one dihydrochloride

CAS Number:

2137960-05-3

Molecular Formula:

C13H22Cl2N4O

Molecular Weight:

321.2460

MDL Number:

MFCD31583687

IUPAC Name:

2-piperazin-1-yl-4a,5,6,7,8,9-hexahydrocyclohepta[d]pyrimidin-4-one;dihydrochloride

InChI:

InChI=1S/C13H20N4O.2ClH/c18-12-10-4-2-1-3-5-11(10)15-13(16-12)17-8-6-14-7-9-17;;/h10,14H,1-9H2;2*1H

InChI Key:

BEUGLLLYJDNVOR-UHFFFAOYSA-N

SMILES:

O=c1[nH]c(nc2c1CCCCC2)N1CCNCC1.Cl.Cl

Complexity:

396

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

320.117g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

321.246g/mol

Monoisotopic Mass:

320.117g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: