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CAS 1172851-61-4 4-chloro-6-iodo-7-Methoxyquinazoline molecular structure lightbox
CAS RN: 1172851-61-4

4-chloro-6-iodo-7-Methoxyquinazoline

Product Availability

Choose a grade to view its available package options.

5 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260127 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250313 100mg / 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
Batchno.20250104 1g Out of stock Inquiry
Batchno.20250629 250mg Out of stock Inquiry
Batchno.20260208 5g Out of stock Inquiry
  • Product code: SSC-017148
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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 1172851-61-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

1172851-61-4 / 4-chloro-6-iodo-7-methoxyquinazoline

4-chloro-6-iodo-7-methoxyquinazoline | MFCD12973651 | Quinazoline, 4-chloro-6-iodo-7-methoxy-

Standard CAS: 1172851-61-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1172851-61-4
Multi CAS
No
Molecular Formula
C9H6ClIN2O
Molecular Weight
320.510000
Exact Mass
319.921340
SMILES
COC1=C(C=C2C(=C1)N=CN=C2Cl)I
InChI
InChI=1S/C9H6ClIN2O/c1-14-8-3-7-5(2-6(8)11)9(10)13-4-12-7/h2-4H,1H3
InChIKey
VGUHUPXWUUVYHC-UHFFFAOYSA-N
Synonyms
4-chloro-6-iodo-7-methoxyquinazoline MFCD12973651 Quinazoline, 4-chloro-6-iodo-7-methoxy- C9H6ClIN2O 4-chloro-6-iodo-7-(methyloxy)quinazoline

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
63.82
TPSA
35.01

LogP / Solubility

WLOGP
2.9
MLOGP
2.56
XLogP3
3.1
Consensus LogP
2.85
Log S (ESOL)
-4.11
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.28
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.27
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.62

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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