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CAS 478706-50-2 (2S)-2-(Fmoc-amino)tetradecanoic acid molecular structure lightbox
CAS RN: 478706-50-2

(2S)-2-(Fmoc-amino)tetradecanoic acid

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260627 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-154824
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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 478706-50-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 0 Out of Stock Shanghai Inquiry

478706-50-2 / 2-(9H-fluoren-9-ylmethoxycarbonylamino)tetradecanoic acid

Standard CAS: 478706-50-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
478706-50-2
Multi CAS
Yes
Molecular Formula
C29H39NO4
Molecular Weight
465.600000
Exact Mass
465.287909
InChI
InChI=1S/C29H39NO4/c1-2-3-4-5-6-7-8-9-10-11-20-27(28(31)32)30-29(33)34-21-26-24-18-14-12-16-22(24)23-17-13-15-19-25(23)26/h12-19,26-27H,2-11,20-21H2,1H3,(H,30,33)(H,31,32)/t27-/m0/s1
InChIKey
IVGHFZFNWWDVLX-MHZLTWQESA-N

Computed Properties

Structural Parameters

Heavy atom count
34
Aromatic heavy atom count
12
Fraction Csp3
0.52
Rotatable bonds
15
H-bond acceptors
3
H-bond donors
2
Molar refractivity
136.09
TPSA
75.63

LogP / Solubility

WLOGP
7.29
MLOGP
6.45
XLogP3
8.8
Consensus LogP
7.51
Log S (ESOL)
-6.59
Class (ESOL)
Insoluble
Log S (Ali)
-8.64
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.54
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.38

Drug-likeness / Medicinal Chemistry

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

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