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CAS 1022-79-3 5-Bromo-2′-deoxycytidine molecular structure lightbox
CAS RN: 1022-79-3

5-Bromo-2′-deoxycytidine

Product Availability

Choose a grade to view its available package options.

9 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250202 1g In stock Inquiry
Batchno.20250812 25g In stock Inquiry
Batchno.20251204 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251030 1g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260426 1g In stock Shanghai Inquiry
Batchno.20250917 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250315 25g In stock Wuhan Inquiry
Batchno.20260310 5g In stock Shanghai, Wuhan Inquiry
Batchno.20250303 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-003478
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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: ≥98%
  • 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 1022-79-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 0 Out of Stock Hong Kong Inquiry

1022-79-3 / 4-amino-5-bromo-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one

SCHEMBL198512 | HY-W011376

Standard CAS: 1022-79-3 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1022-79-3
Multi CAS
Yes
Molecular Formula
C9H12BrN3O4
Molecular Weight
306.110000
Exact Mass
305.001120
SMILES
C1[C@@H]([C@H](O[C@H]1N2C=C(C(=NC2=O)N)Br)CO)O
InChI
InChI=1S/C9H12BrN3O4/c10-4-2-13(9(16)12-8(4)11)7-1-5(15)6(3-14)17-7/h2,5-7,14-15H,1,3H2,(H2,11,12,16)/t5-,6+,7+/m0/s1
InChIKey
KISUPFXQEHWGAR-RRKCRQDMSA-N
Synonyms
SCHEMBL198512 HY-W011376

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
2
H-bond acceptors
7
H-bond donors
3
Molar refractivity
62.23
TPSA
110.6

LogP / Solubility

WLOGP
-0.77
MLOGP
-0.67
XLogP3
-0.9
Consensus LogP
-0.78
Log S (ESOL)
-1.38
Class (ESOL)
Soluble
Log S (Ali)
-1.51
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.25
Class (SILICOS-IT)
Soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Health Hazard
Signal
Warning
GHS Hazard Statements
H351 (100%): Suspected of causing cancer [Warning Carcinogenicity]
Precautionary Statement Codes
P203, P280, P318, P405, and P501

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