CAS RN: 195822-23-2

LQZ-7I

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250909 100mg In stock Shanghai Inquiry
Batchno.20251227 10mg In stock Shanghai Inquiry
Batchno.20250216 1mg In stock Shanghai Inquiry
Batchno.20251010 25mg In stock Shanghai Inquiry
Batchno.20250525 50mg In stock Shanghai Inquiry
Batchno.20260503 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS195822-23-2
  • Purity/Analytical Methods: >99.0%
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195822-23-2 / 2-N,3-N-bis(4-fluorophenyl)quinoxaline-2,3-diamine

Standard CAS: 195822-23-2 Multi CAS: No

Basic Information

CAS
195822-23-2
Multi CAS
No
Molecular Formula
C20H14F2N4
Molecular Weight
348.300000
Exact Mass
348.118653
SMILES
C1=CC=C2C(=C1)N=C(C(=N2)NC3=CC=C(C=C3)F)NC4=CC=C(C=C4)F
InChI
InChI=1S/C20H14F2N4/c21-13-5-9-15(10-6-13)23-19-20(24-16-11-7-14(22)8-12-16)26-18-4-2-1-3-17(18)25-19/h1-12H,(H,23,25)(H,24,26)
InChIKey
DKPCKOKYSVPFEB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
22
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
98.9
TPSA
49.84

LogP / Solubility

WLOGP
5.4
MLOGP
4.77
XLogP3
5.2
Consensus LogP
5.12
Log S (ESOL)
-5.76
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.31
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.88
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.01

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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