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CAS 1225278-65-8 BenzenaMine, 4-[(2-chloro-4-pyridinyl)oxy]-2,5-difluoro- molecular structure lightbox
CAS RN: 1225278-65-8

BenzenaMine, 4-[(2-chloro-4-pyridinyl)oxy]-2,5-difluoro-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260507 100mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-025473
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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: ≥95%
  • 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 1225278-65-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1225278-65-8 / 4-[(2-chloro-4-pyridinyl)oxy]-2,5-difluoroaniline

Standard CAS: 1225278-65-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1225278-65-8
Multi CAS
No
Molecular Formula
C11H7ClF2N2O
Molecular Weight
256.630000
Exact Mass
256.021497
SMILES
C1=CN=C(C=C1OC2=C(C=C(C(=C2)F)N)F)Cl
InChI
InChI=1S/C11H7ClF2N2O/c12-11-3-6(1-2-16-11)17-10-5-7(13)9(15)4-8(10)14/h1-5H,15H2
InChIKey
UGOHGIBWMNXIOM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
60.09
TPSA
48.14

LogP / Solubility

WLOGP
3.39
MLOGP
2.99
XLogP3
2.9
Consensus LogP
3.09
Log S (ESOL)
-3.96
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.11
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.38
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.88

Drug-likeness / Medicinal Chemistry

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

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