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CAS 2279-15-4 Nα-Carbobenzoxy-D-tryptophan molecular structure lightbox
CAS RN: 2279-15-4

Nα-Carbobenzoxy-D-tryptophan

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260201 100g In stock Shanghai Inquiry
Batchno.20260307 1g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260330 25g In stock Shanghai Inquiry
Batchno.20251112 500g In stock Shanghai Inquiry
Batchno.20251219 5g In stock Shanghai Inquiry
  • Product code: SSC-110957
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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: 25g
  • 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 2279-15-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Shenzhen Inquiry

2279-15-4 / 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid

Standard CAS: 2279-15-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2279-15-4
Multi CAS
No
Molecular Formula
C19H18N2O4
Molecular Weight
338.400000
Exact Mass
338.126657
SMILES
C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O
InChI
InChI=1S/C19H18N2O4/c22-18(23)17(10-14-11-20-16-9-5-4-8-15(14)16)21-19(24)25-12-13-6-2-1-3-7-13/h1-9,11,17,20H,10,12H2,(H,21,24)(H,22,23)
InChIKey
AHYFYYVVAXRMKB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
15
Fraction Csp3
0.16
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
3
Molar refractivity
93.19
TPSA
91.42

LogP / Solubility

WLOGP
3.09
MLOGP
2.74
XLogP3
2.3
Consensus LogP
2.71
Log S (ESOL)
-3.93
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.57
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.14
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)
-2.59

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

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