[email protected]
CAS 99185-71-4 4-AMINO-6-NITRO-QUINALDINE molecular structure lightbox
CAS RN: 99185-71-4

4-AMINO-6-NITRO-QUINALDINE

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250409 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS99185-71-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

99185-71-4 / 2-methyl-6-nitroquinolin-4-amine

Standard CAS: 99185-71-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
99185-71-4
Multi CAS
No
Molecular Formula
C10H9N3O2
Molecular Weight
203.200000
Exact Mass
203.069477
InChI
InChI=1S/C10H9N3O2/c1-6-4-9(11)8-5-7(13(14)15)2-3-10(8)12-6/h2-5H,1H3,(H2,11,12)
InChIKey
BJGZNGVTLAUJID-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.1
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
57.55
TPSA
82.05

LogP / Solubility

WLOGP
2.03
MLOGP
1.79
XLogP3
1.7
Consensus LogP
1.84
Log S (ESOL)
-2.81
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.69
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.79
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.52

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us