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CAS 84905-80-6 4-CHLORO-5H-PYRROLO[3,2-D] PYRIMIDINE molecular structure lightbox
CAS RN: 84905-80-6

4-CHLORO-5H-PYRROLO[3,2-D] PYRIMIDINE

Product Availability

Choose a grade to view its available package options.

6 package records3 with current stock3 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250419 10g Out of stock Inquiry
Batchno.20250209 1g In stock Inquiry
Batchno.20250130 25g In stock Inquiry
Batchno.20250504 5g In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260105 1g / 5g / 25g Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260212 250mg / 1g / 5g / 25g / 100g Out of stock 5-7 business days Inquiry
  • Product code: SSC-192630
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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, 5g, 10g, 25g
  • 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 84905-80-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 0 Out of Stock Shanghai Inquiry
5g >95% 0 Out of Stock Beijing Inquiry
10g >95% 0 Out of Stock Shenzhen Inquiry
25g >95% 0 Out of Stock Shenzhen Inquiry

84905-80-6 / 4-chloro-5H-pyrrolo[3,2-d]pyrimidine

Standard CAS: 84905-80-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
84905-80-6
Multi CAS
Yes
Molecular Formula
C6H4CLN3
Molecular Weight
153.570000
Exact Mass
153.009375
InChI
InChI=1S/C6H4ClN3/c7-6-5-4(1-2-8-5)9-3-10-6/h1-3,8H
InChIKey
ZGJDDWOXVGDTSP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.9
TPSA
41.57

LogP / Solubility

WLOGP
1.61
MLOGP
1.41
XLogP3
1.4
Consensus LogP
1.47
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.98
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.51

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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