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CAS 32513-92-1 α,ε-Dibenzoyl-DL-lysine molecular structure lightbox
CAS RN: 32513-92-1

α,ε-Dibenzoyl-DL-lysine

Product Availability

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2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250812 1g In stock Inquiry
Batchno.20250811 5g In stock Inquiry
  • Product code: SSC-138108
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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: ≥99%
  • 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 32513-92-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥99% 0 Out of Stock Beijing Inquiry

32513-92-1 / 2,6-dibenzamidohexanoic acid

Standard CAS: 32513-92-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
32513-92-1
Multi CAS
Yes
Molecular Formula
C20H22N2O4
Molecular Weight
354.400000
Exact Mass
354.157957
InChI
InChI=1S/C20H22N2O4/c23-18(15-9-3-1-4-10-15)21-14-8-7-13-17(20(25)26)22-19(24)16-11-5-2-6-12-16/h1-6,9-12,17H,7-8,13-14H2,(H,21,23)(H,22,24)(H,25,26)
InChIKey
WZWYZPFOTAVDKN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
12
Fraction Csp3
0.25
Rotatable bonds
9
H-bond acceptors
3
H-bond donors
3
Molar refractivity
97.96
TPSA
95.5

LogP / Solubility

WLOGP
2.47
MLOGP
2.19
XLogP3
2.9
Consensus LogP
2.52
Log S (ESOL)
-3.34
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.25
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.09
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)
-3.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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