![CAS 1254567-75-3 5-cyclopropyl-1H-pyrrolo[2,3-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1254567-75-3.gif)
CAS RN: 1254567-75-3
5-cyclopropyl-1H-pyrrolo[2,3-b]pyridine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260601 | 100mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS1254567-75-3
- Purity/Analytical Methods: >99.0%
1254567-75-3 / 5-cyclopropyl-1H-pyrrolo[2,3-b]pyridine
Basic Information
CAS
1254567-75-3
Multi CAS
No
Molecular Formula
C10H10N2
Molecular Weight
158.200000
Exact Mass
158.084398
SMILES
C1CC1C2=CN=C3C(=C2)C=CN3
InChI
InChI=1S/C10H10N2/c1-2-7(1)9-5-8-3-4-11-10(8)12-6-9/h3-7H,1-2H2,(H,11,12)
InChIKey
JSVGZEXTHLLLQF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.3
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.07
TPSA
28.68
LogP / Solubility
WLOGP
2.44
MLOGP
2.14
XLogP3
2.2
Consensus LogP
2.26
Log S (ESOL)
-2.85
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.62
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.83
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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![CAS 1254710-16-1 8-BROMO-7-CHLORO-2-PHENYL-[1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1254710-16-1.gif)
