![CAS 1284293-40-8 (6-Bromoimidazo[1,2-a]pyridin-3-yl)(phenyl)methanone molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/1284293-40-8.png)
CAS RN: 1284293-40-8
(6-Bromoimidazo[1,2-a]pyridin-3-yl)(phenyl)methanone
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260217 | 100g | Out of stock | 5-7 business days | Inquiry |
- Product code: LINB900038
1284293-40-8 / (6-bromoimidazo[1,2-a]pyridin-3-yl)-phenylmethanone
Basic Information
CAS
1284293-40-8
Multi CAS
No
Molecular Formula
C14H9BrN2O
Molecular Weight
301.140000
Exact Mass
299.989830
SMILES
C1=CC=C(C=C1)C(=O)C2=CN=C3N2C=C(C=C3)Br
InChI
InChI=1S/C14H9BrN2O/c15-11-6-7-13-16-8-12(17(13)9-11)14(18)10-4-2-1-3-5-10/h1-9H
InChIKey
WDRHENMONWPLEC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
15
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
72.77
TPSA
34.37
LogP / Solubility
WLOGP
3.33
MLOGP
2.94
XLogP3
4.1
Consensus LogP
3.46
Log S (ESOL)
-4.29
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.43
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.62
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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