![CAS 143468-07-9 methyl 6-chloro-1H-pyrrolo[2,3-b]pyridin-1-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/143468-07-9.png)
CAS RN: 143468-07-9
methyl 6-chloro-1H-pyrrolo[2,3-b]pyridin-1-carboxylate
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250212 | 200mg | Out of stock | 5-7 business days | Inquiry |
- Product code: LINH926953
143468-07-9 / methyl 6-chloropyrrolo[2,3-b]pyridine-1-carboxylate
Basic Information
CAS
143468-07-9
Multi CAS
No
Molecular Formula
C9H7ClN2O2
Molecular Weight
210.620000
Exact Mass
210.019605
SMILES
COC(=O)N1C=CC2=C1N=C(C=C2)Cl
InChI
InChI=1S/C9H7ClN2O2/c1-14-9(13)12-5-4-6-2-3-7(10)11-8(6)12/h2-5H,1H3
InChIKey
YCPHTTJYZGPHIS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
52.55
TPSA
44.12
LogP / Solubility
WLOGP
2.3
MLOGP
2.03
XLogP3
2.5
Consensus LogP
2.28
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.95
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.94
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.37
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
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![CAS 258497-48-2 Methyl 6-([(2-methyl-2-propanyl)oxy]carbonylamino)-2-pyridinecarboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/258497-48-2.png)
![CAS 870006-68-1 Methyl 8-methoxy-11-methyl-6,10-dioxo-1,4,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2(7),3,8-triene-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/870006-68-1.png)
