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CAS 23746-76-1 1H-INDOLE, 5-CHLORO-2-PHENYL- molecular structure lightbox
CAS RN: 23746-76-1

1H-INDOLE, 5-CHLORO-2-PHENYL-

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250701 50mg / 250mg / 1g / 5g Confirm by inquiry Shandong, Shanghai 8-10 business days Inquiry
  • Product code: SSC-115359
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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: ＞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 23746-76-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Shanghai Inquiry

23746-76-1 / 5-chloro-2-phenyl-1H-indole

Standard CAS: 23746-76-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
23746-76-1
Multi CAS
No
Molecular Formula
C14H10ClN
Molecular Weight
227.690000
Exact Mass
227.050177
SMILES
C1=CC=C(C=C1)C2=CC3=C(N2)C=CC(=C3)Cl
InChI
InChI=1S/C14H10ClN/c15-12-6-7-13-11(8-12)9-14(16-13)10-4-2-1-3-5-10/h1-9,16H
InChIKey
GQGZSWYJDNGSBE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond donors
1
Molar refractivity
68.74
TPSA
15.79

LogP / Solubility

WLOGP
4.49
MLOGP
3.95
XLogP3
4.3
Consensus LogP
4.25
Log S (ESOL)
-4.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.67
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.99
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)
-0.92

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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