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CAS 1190312-66-3 4-Fluoro-5-aza-2-oxindole molecular structure lightbox
CAS RN: 1190312-66-3

4-Fluoro-5-aza-2-oxindole

  • Product code: SSC-019334
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1190312-66-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 2 In Stock Shenzhen Inquiry
0.25g >95% 2 In Stock Shanghai Inquiry
1g >95% 0 Out of Stock Shanghai Inquiry

1190312-66-3 / 4-fluoro-1,3-dihydropyrrolo[3,2-c]pyridin-2-one

4-Fluoro-5-aza-2-oxindole | 4-Fluoro-1H-pyrrolo[3,2-c]pyridin-2(3H)-one | 4-fluoro-1,3-dihydropyrrolo[3,2-c]pyridin-2-one

Standard CAS: 1190312-66-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1190312-66-3
Multi CAS
No
Molecular Formula
C7H5FN2O
Molecular Weight
152.130000
Exact Mass
152.038591
SMILES
C1C2=C(C=CN=C2F)NC1=O
InChI
InChI=1S/C7H5FN2O/c8-7-4-3-6(11)10-5(4)1-2-9-7/h1-2H,3H2,(H,10,11)
InChIKey
UZEIPGVQAAJMOC-UHFFFAOYSA-N
Synonyms
4-Fluoro-5-aza-2-oxindole 4-Fluoro-1H-pyrrolo[3,2-c]pyridin-2(3H)-one 4-fluoro-1,3-dihydropyrrolo[3,2-c]pyridin-2-one 4-fluoro-1H,2H,3H-pyrrolo[3,2-c]pyridin-2-one MFCD12963227

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.14
H-bond acceptors
2
H-bond donors
1
Molar refractivity
36.53
TPSA
41.99

LogP / Solubility

WLOGP
0.72
MLOGP
0.62
XLogP3
0.1
Consensus LogP
0.48
Log S (ESOL)
-1.64
Class (ESOL)
Soluble
Log S (Ali)
-1.32
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.24
Class (SILICOS-IT)
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)
-3.14

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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