[email protected]
CAS 1079-46-5 METHYL 5-CHLORO-1H-INDAZOLE-3-CARBOXYLATE molecular structure lightbox
CAS RN: 1079-46-5

METHYL 5-CHLORO-1H-INDAZOLE-3-CARBOXYLATE

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260331 100mg In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20260422 1g In stock Shanghai Inquiry
Batchno.20250225 250mg In stock Shanghai Inquiry
Batchno.20250209 5g In stock Shanghai Inquiry
  • Product code: SSC-009222
GET A QUOTE
Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 0.1g, 0.25g, 5g
  • Available purity: ≥97%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1079-46-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Shenzhen Inquiry
0.1g ≥97% 1 In Stock Shenzhen Inquiry
0.25g ≥97% 1 In Stock Beijing Inquiry
5g ≥97% 1 In Stock Hong Kong Inquiry

1079-46-5 / methyl 5-chloro-1H-indazole-3-carboxylate

RefChem:1058093 | 1H-Indazole-3-carboxylic acid, 5-chloro-, methyl ester | methyl 5-chloro-1H-indazole-3-carboxylate

Standard CAS: 1079-46-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1079-46-5
Multi CAS
Yes
Molecular Formula
C9H7ClN2O2
Molecular Weight
210.620000
Exact Mass
210.019605
SMILES
COC(=O)C1=NNC2=C1C=C(C=C2)Cl
InChI
InChI=1S/C9H7ClN2O2/c1-14-9(13)8-6-4-5(10)2-3-7(6)11-12-8/h2-4H,1H3,(H,11,12)
InChIKey
OFHGAYNAKIWVOL-UHFFFAOYSA-N
Synonyms
RefChem:1058093 1H-Indazole-3-carboxylic acid, 5-chloro-, methyl ester methyl 5-chloro-1H-indazole-3-carboxylate MFCD07371574 5-chloro-1h-indazole-3-carboxylic acid methyl ester

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
52.44
TPSA
54.98

LogP / Solubility

WLOGP
2
MLOGP
1.76
XLogP3
2.4
Consensus LogP
2.05
Log S (ESOL)
-2.82
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.73
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.81
Class (SILICOS-IT)
Moderately 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)
-2.58

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us