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CAS 1190314-69-2 5-Flouro-7-azaindole-3-carboxylic acid Methyl ester molecular structure lightbox
CAS RN: 1190314-69-2

5-Flouro-7-azaindole-3-carboxylic acid Methyl ester

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250430 100mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-019357
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1190314-69-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

1190314-69-2 / methyl 5-fluoro-1H-pyrrolo[2,3-b]pyridine-3-carboxylate

METHYL 5-FLUORO-7-AZAINDOLE-3-CARBOXYLATE | METHYL 5-FLUORO-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLATE | 5-FLUORO-7-AZAINDOLE-3-CARBOXYLIC ACID METHYL ESTER

Standard CAS: 1190314-69-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1190314-69-2
Multi CAS
No
Molecular Formula
C9H7FN2O2
Molecular Weight
194.160000
Exact Mass
194.049156
SMILES
COC(=O)C1=CNC2=C1C=C(C=N2)F
InChI
InChI=1S/C9H7FN2O2/c1-14-9(13)7-4-12-8-6(7)2-5(10)3-11-8/h2-4H,1H3,(H,11,12)
InChIKey
SDFAOMSNGRJZID-UHFFFAOYSA-N
Synonyms
METHYL 5-FLUORO-7-AZAINDOLE-3-CARBOXYLATE METHYL 5-FLUORO-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLATE 5-FLUORO-7-AZAINDOLE-3-CARBOXYLIC ACID METHYL ESTER MFCD12962794 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 5-fluoro-, methyl ester

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
47.39
TPSA
54.98

LogP / Solubility

WLOGP
1.49
MLOGP
1.31
XLogP3
1.3
Consensus LogP
1.37
Log S (ESOL)
-2.39
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.23
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.28
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)
-2.85

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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