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CAS 124695-22-3 1-(2-CHLORO-PHENYL)-1H-PYRROLE-2-CARBALDEHYDE molecular structure lightbox
CAS RN: 124695-22-3

1-(2-CHLORO-PHENYL)-1H-PYRROLE-2-CARBALDEHYDE

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250727 100mg In stock Shanghai Inquiry
Batchno.20260309 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
Batchno.20251015 1g In stock Shanghai Inquiry
Batchno.20251210 250mg In stock Shanghai Inquiry
  • Product code: SSC-028806
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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, 0.25g, 1g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • 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 124695-22-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 5 In Stock Shenzhen Inquiry
0.1g >97% 5 In Stock Shenzhen Inquiry
0.25g -- 5 In Stock Shenzhen Inquiry
0.25g >97% 5 In Stock Shanghai Inquiry
1g -- 5 In Stock Shanghai Inquiry
1g >97% 5 In Stock Beijing Inquiry

124695-22-3 / 1-(2-chlorophenyl)pyrrole-2-carbaldehyde

Standard CAS: 124695-22-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
124695-22-3
Multi CAS
No
Molecular Formula
C11H8ClNO
Molecular Weight
205.640000
Exact Mass
205.029442
SMILES
C1=CC=C(C(=C1)N2C=CC=C2C=O)Cl
InChI
InChI=1S/C11H8ClNO/c12-10-5-1-2-6-11(10)13-7-3-4-9(13)8-14/h1-8H
InChIKey
ZGGBSDXOHAFIOQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
11
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
56.17
TPSA
22

LogP / Solubility

WLOGP
2.94
MLOGP
2.59
XLogP3
2.7
Consensus LogP
2.74
Log S (ESOL)
-3.42
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.37
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.68
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)
-1.88

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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