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CAS 135912-30-0 2-Pyridinecarboxamide, N,N’-[(1S,2S)-1,2-diphenyl-1,2-ethanediyl]bis- molecular structure lightbox
CAS RN: 135912-30-0

2-Pyridinecarboxamide, N,N’-[(1S,2S)-1,2-diphenyl-1,2-ethanediyl]bis-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260318 5mg / 25mg / 100mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-044493
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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: 0.1g
  • 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 135912-30-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Shanghai Inquiry

135912-30-0 / N-[(1S,2S)-1,2-diphenyl-2-(pyridine-2-carbonylamino)ethyl]pyridine-2-carboxamide

Standard CAS: 135912-30-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
135912-30-0
Multi CAS
No
Molecular Formula
C26H22N4O2
Molecular Weight
422.500000
Exact Mass
422.174276
SMILES
C1=CC=C(C=C1)[C@@H]([C@H](C2=CC=CC=C2)NC(=O)C3=CC=CC=N3)NC(=O)C4=CC=CC=N4
InChI
InChI=1S/C26H22N4O2/c31-25(21-15-7-9-17-27-21)29-23(19-11-3-1-4-12-19)24(20-13-5-2-6-14-20)30-26(32)22-16-8-10-18-28-22/h1-18,23-24H,(H,29,31)(H,30,32)/t23-,24-/m0/s1
InChIKey
FVOGBPNYKUVGES-ZEQRLZLVSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
24
Fraction Csp3
0.08
Rotatable bonds
7
H-bond acceptors
4
H-bond donors
2
Molar refractivity
121.77
TPSA
83.98

LogP / Solubility

WLOGP
4.12
MLOGP
3.65
XLogP3
3.8
Consensus LogP
3.86
Log S (ESOL)
-5.15
Class (ESOL)
Slightly soluble
Log S (Ali)
-6
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.66
Class (SILICOS-IT)
Insoluble

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
Yes
Log Kp (skin permeation)
-2.37

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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