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CAS 136831-49-7 Tyrphostin RG 14620 molecular structure lightbox
CAS RN: 136831-49-7

Tyrphostin RG 14620

Product Availability

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2 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250626 25mg Out of stock Inquiry
Batchno.20250121 5mg Out of stock Inquiry
  • Product code: SSC-045974
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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: 0.25g
  • 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 136831-49-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry

136831-49-7 / (Z)-3-(3,5-dichlorophenyl)-2-pyridin-3-ylprop-2-enenitrile

Standard CAS: 136831-49-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
136831-49-7
Multi CAS
No
Molecular Formula
C14H8Cl2N2
Molecular Weight
275.100000
Exact Mass
274.006454
SMILES
C1=CC(=CN=C1)/C(=C/C2=CC(=CC(=C2)Cl)Cl)/C#N
InChI
InChI=1S/C14H8Cl2N2/c15-13-5-10(6-14(16)7-13)4-12(8-17)11-2-1-3-18-9-11/h1-7,9H/b12-4+
InChIKey
TYXIVBJQPBWBHO-UUILKARUSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
74.18
TPSA
36.68

LogP / Solubility

WLOGP
4.45
MLOGP
3.93
XLogP3
3.9
Consensus LogP
4.09
Log S (ESOL)
-4.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.03
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.38
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.24

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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