CAS RN: 1190312-22-1
6-Methoxy-7-azaindole-4-carboxylic acid Methyl ester
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.20250221 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1190312-22-1
- Purity/Analytical Methods: >99.0%
1190312-22-1 / methyl 6-methoxy-1H-pyrrolo[2,3-b]pyridine-4-carboxylate
methyl 6-methoxy-1H-pyrrolo[2,3-b]pyridine-4-carboxylate | 6-METHOXY-7-AZAINDOLE-4-CARBOXYLIC ACID METHYL ESTER | MFCD12962736
Basic Information
CAS
1190312-22-1
Multi CAS
No
Molecular Formula
C10H10N2O3
Molecular Weight
206.200000
Exact Mass
206.069142
SMILES
COC1=NC2=C(C=CN2)C(=C1)C(=O)OC
InChI
InChI=1S/C10H10N2O3/c1-14-8-5-7(10(13)15-2)6-3-4-11-9(6)12-8/h3-5H,1-2H3,(H,11,12)
InChIKey
UHIOSDXEZFZBCH-UHFFFAOYSA-N
Synonyms
methyl 6-methoxy-1H-pyrrolo[2,3-b]pyridine-4-carboxylate
6-METHOXY-7-AZAINDOLE-4-CARBOXYLIC ACID METHYL ESTER
MFCD12962736
6-Methoxy-7-azaindole-4-carboxylic acid
H39012
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
9
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
53.99
TPSA
64.21
LogP / Solubility
WLOGP
1.36
MLOGP
1.2
XLogP3
1.5
Consensus LogP
1.35
Log S (ESOL)
-2.29
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.23
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.37
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.01
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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3-BroMo-4-azaindole-6-carboxylic acid Methyl ester
- CAS RN: 1190312-64-1
- Product Code: SSC-019333
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