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CAS 1093645-21-6 (R)-N-Fmoc-2-(4′-pentenyl)glycine molecular structure lightbox
CAS RN: 1093645-21-6

(R)-N-Fmoc-2-(4′-pentenyl)glycine

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250608 50mg / 250mg / 1g Confirm by inquiry Shanghai 30 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251108 100mg In stock Inquiry
Batchno.20250617 1g In stock Inquiry
Batchno.20250721 250mg In stock Inquiry
  • Product code: SSC-010633
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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: ≥97%
  • 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 1093645-21-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Hong Kong Inquiry

1093645-21-6 / (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hept-6-enoic acid

(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)hept-6-enoic acid | (R)-N-Fmoc-2-(4'-pentenyl)glycine | MFCD17215632

Standard CAS: 1093645-21-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1093645-21-6
Multi CAS
Yes
Molecular Formula
C22H23NO4
Molecular Weight
365.400000
Exact Mass
365.162708
SMILES
C=CCCC[C@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C22H23NO4/c1-2-3-4-13-20(21(24)25)23-22(26)27-14-19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19/h2,5-12,19-20H,1,3-4,13-14H2,(H,23,26)(H,24,25)/t20-/m1/s1
InChIKey
LRSIYGFZZWFAAI-HXUWFJFHSA-N
Synonyms
(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)hept-6-enoic acid (R)-N-Fmoc-2-(4'-pentenyl)glycine MFCD17215632 (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hept-6-enoic acid (2R)-2-(Fmoc-amino)-6-heptenoic acid

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.27
Rotatable bonds
8
H-bond acceptors
3
H-bond donors
2
Molar refractivity
103.68
TPSA
75.63

LogP / Solubility

WLOGP
4.33
MLOGP
3.83
XLogP3
4.5
Consensus LogP
4.22
Log S (ESOL)
-4.64
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.69
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.59
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
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)
-1.87

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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