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CAS 1375064-43-9 Ethyl 3-BroMo-7-Methylindole-1-carboxylate molecular structure lightbox
CAS RN: 1375064-43-9

Ethyl 3-BroMo-7-Methylindole-1-carboxylate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251107 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-047141
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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: 0.1g, 1g, 0.25g, 5g
  • Available purity: ≥97%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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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 1375064-43-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥97% 5 In Stock Hong Kong Inquiry
1g ≥97% 5 In Stock Shenzhen Inquiry
0.25g ≥97% 1 In Stock Beijing Inquiry
5g ≥97% 1 In Stock Hong Kong Inquiry

1375064-43-9 / ethyl 3-bromo-7-methylindole-1-carboxylate

Standard CAS: 1375064-43-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1375064-43-9
Multi CAS
No
Molecular Formula
C12H12BrNO2
Molecular Weight
282.130000
Exact Mass
281.005140
SMILES
CCOC(=O)N1C=C(C2=CC=CC(=C21)C)Br
InChI
InChI=1S/C12H12BrNO2/c1-3-16-12(15)14-7-10(13)9-6-4-5-8(2)11(9)14/h4-7H,3H2,1-2H3
InChIKey
HYBXWXSTGDLURK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
9
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
66.8
TPSA
31.23

LogP / Solubility

WLOGP
3.72
MLOGP
3.28
XLogP3
3.7
Consensus LogP
3.57
Log S (ESOL)
-4.28
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.56
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.7
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.8

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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