Chemryt - We contribute to the Chemicals, Pharmaceutical & Biotech industry using information technology

C13H13N5 | Cheminformatics

N-[(Z)-quinolin-4-ylmethylideneamino]-4,5-dihydro-1H-imidazol-2-amine

Molecular Formula : C13H13N5 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |

MolName : N-[(Z)-quinolin-4-ylmethylideneamino]-4,5-dihydro-1H-imidazol-2-amine

MolecularFormula : C13H13N5

Smiles : C1NC(N/N=C\c2ccnc3ccccc23)=NC1

InChI : InChI=1S/C13H13N5/c1-2-4-12-11(3-1)10(5-6-14-12)9-17-18-13-15-7-8-16-13/h1-6,9H,7-8H2,(H2,15,16,18)

InChIK : VNMIEIYSZTVQEP-UHFFFAOYSA-N

TotalMolweight : 239.281

Molweight : 239.281

MonoisotopicMass : 239.117095

CLogP : 1.7298

CLogS : -3.638

H Acceptors : 5

H Donors : 2

TotalSurfaceArea : 191.29

Relative PSA : 0.29751

PolarSurfaceArea : 61.67

Druglikeness : 5.6825

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : imine/hydrazone of aldehyde

Shape Index : 0.61111

Fragments : 1

Non HAtoms : 18

NonCHAtoms : 5

Electronegative Atoms : 5

Rotatable Bond : 2

Rings Closures : 3

Small Rings : 3

Aromatic Rings : 2

Aromatic Atoms : 10

Sp3Atoms : 2

Aromatic Nitrogens : 1

BasicNitrogens : 1

StereoCon :

Request More Details | N-[(Z)-quinolin-4-ylmethylideneamino]-4,5-dihydro-1H-imidazol-2-amine


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments