CAS RN: 928774-43-0
PF03716556
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250613 | 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS928774-43-0
- Purity/Analytical Methods: >99.0%
928774-43-0 / N-(2-hydroxyethyl)-N,2-dimethyl-8-[(5-methyl-3,4-dihydro-2H-chromen-4-yl)amino]imidazo[1,2-a]pyridine-6-carboxamide
Basic Information
CAS
928774-43-0
Multi CAS
Yes
Molecular Formula
C22H26N4O3
Molecular Weight
394.500000
Exact Mass
394.200491
InChI
InChI=1S/C22H26N4O3/c1-14-5-4-6-19-20(14)17(7-10-29-19)24-18-11-16(22(28)25(3)8-9-27)13-26-12-15(2)23-21(18)26/h4-6,11-13,17,24,27H,7-10H2,1-3H3/t17-/m1/s1
InChIKey
YBHKBMJREUZHOV-QGZVFWFLSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
15
Fraction Csp3
0.36
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
2
Molar refractivity
111.63
TPSA
79.1
LogP / Solubility
WLOGP
2.95
MLOGP
2.62
XLogP3
2.9
Consensus LogP
2.82
Log S (ESOL)
-4.2
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.93
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.27
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.03
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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