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CAS 105751-18-6 NEPSILON-FMOC-NALPHA-CBZ-L-LYSINE, 98 molecular structure lightbox
CAS RN: 105751-18-6

NEPSILON-FMOC-NALPHA-CBZ-L-LYSINE, 98

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251116 5g / 25g / 100g Out of stock 5-7 business days Inquiry
  • Product code: SSC-007452
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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: 5g
  • 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 105751-18-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

105751-18-6 / (2S)-6-(9H-fluoren-9-ylmethoxycarbonylamino)-2-(phenylmethoxycarbonylamino)hexanoic acid

Z-Lys(Fmoc)-OH | (S)-6-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-(((benzyloxy)carbonyl)amino)hexanoic acid | NEPSILON-FMOC-NALPHA-CBZ-L-LYSINE, 98

Standard CAS: 105751-18-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
105751-18-6
Multi CAS
Yes
Molecular Formula
C29H30N2O6
Molecular Weight
502.600000
Exact Mass
502.210387
SMILES
C1=CC=C(C=C1)COC(=O)N[C@@H](CCCCNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O
InChI
InChI=1S/C29H30N2O6/c32-27(33)26(31-29(35)36-18-20-10-2-1-3-11-20)16-8-9-17-30-28(34)37-19-25-23-14-6-4-12-21(23)22-13-5-7-15-24(22)25/h1-7,10-15,25-26H,8-9,16-19H2,(H,30,34)(H,31,35)(H,32,33)/t26-/m0/s1
InChIKey
LNKKPRSYVVUBTR-SANMLTNESA-N
Synonyms
Z-Lys(Fmoc)-OH (S)-6-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-(((benzyloxy)carbonyl)amino)hexanoic acid NEPSILON-FMOC-NALPHA-CBZ-L-LYSINE, 98 Cbz-Lys(Fmoc)-OH MFCD26793642

Computed Properties

Structural Parameters

Heavy atom count
37
Aromatic heavy atom count
18
Fraction Csp3
0.28
Rotatable bonds
11
H-bond acceptors
5
H-bond donors
3
Molar refractivity
138.11
TPSA
113.96

LogP / Solubility

WLOGP
5.08
MLOGP
4.5
XLogP3
5
Consensus LogP
4.86
Log S (ESOL)
-5.79
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.35
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.46
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.18

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.56
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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