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CAS 1107694-84-7 2,8-Dichloroquinazolin-4-aMine molecular structure lightbox
CAS RN: 1107694-84-7

2,8-Dichloroquinazolin-4-aMine

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250517 250mg / 1g / 5g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-011740
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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 1107694-84-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Hong Kong Inquiry

1107694-84-7 / 2,8-dichloroquinazolin-4-amine

2,8-Dichloroquinazolin-4-amine | MFCD11858259 | 2,8-dichloroquinazoline-4-amine

Standard CAS: 1107694-84-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1107694-84-7
Multi CAS
No
Molecular Formula
C8H5Cl2N3
Molecular Weight
214.050000
Exact Mass
212.986053
SMILES
C1=CC2=C(C(=C1)Cl)N=C(N=C2N)Cl
InChI
InChI=1S/C8H5Cl2N3/c9-5-3-1-2-4-6(5)12-8(10)13-7(4)11/h1-3H,(H2,11,12,13)
InChIKey
BWHIMSYPTNZFDJ-UHFFFAOYSA-N
Synonyms
2,8-Dichloroquinazolin-4-amine MFCD11858259 2,8-dichloroquinazoline-4-amine 28-Dichloroquinazolin-4-amine SCHEMBL2916286

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.97
TPSA
51.8

LogP / Solubility

WLOGP
2.52
MLOGP
2.22
XLogP3
2.8
Consensus LogP
2.51
Log S (ESOL)
-3.32
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.13
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.14
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.24

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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