CAS RN: 942436-93-3
3-CinnolinecarboxaMide, 4-aMino-8-(2,5-diMethoxyphenyl)-N-propyl-
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250512 | 100mg | In stock | Inquiry | |
| Batchno.20250703 | 10mg | In stock | Inquiry | |
| Batchno.20251020 | 1mg | In stock | Inquiry | |
| Batchno.20251006 | 1mg / 5mg | Out of stock | 5-7 business days | Inquiry |
| Batchno.20260211 | 25mg | In stock | Inquiry | |
| Batchno.20250720 | 50mg | In stock | Inquiry | |
| Batchno.20250115 | 5mg | In stock | Inquiry |
- Product code: starshine_CAS942436-93-3
- Purity/Analytical Methods: >99.0%
942436-93-3 / 4-amino-8-(2,5-dimethoxyphenyl)-N-propylcinnoline-3-carboxamide
Basic Information
CAS
942436-93-3
Multi CAS
No
Molecular Formula
C20H22N4O3
Molecular Weight
366.400000
Exact Mass
366.169191
InChI
InChI=1S/C20H22N4O3/c1-4-10-22-20(25)19-17(21)14-7-5-6-13(18(14)23-24-19)15-11-12(26-2)8-9-16(15)27-3/h5-9,11H,4,10H2,1-3H3,(H2,21,23)(H,22,25)
InChIKey
NVWCZRPXYVDQEE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
16
Fraction Csp3
0.25
Rotatable bonds
6
H-bond acceptors
6
H-bond donors
2
Molar refractivity
105.11
TPSA
99.36
LogP / Solubility
WLOGP
3.04
MLOGP
2.69
XLogP3
3.1
Consensus LogP
2.94
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.76
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.28
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.8
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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