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CAS 69209-73-0 BOC-VAL-VAL-OH molecular structure lightbox
CAS RN: 69209-73-0

BOC-VAL-VAL-OH

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251102 1g In stock Shanghai, Chengdu Inquiry
Batchno.20250104 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
Batchno.20250404 250mg In stock Shenzhen, Tianjin Inquiry
Batchno.20250725 25g In stock Chengdu Inquiry
Batchno.20260503 5g Out of stock Inquiry
  • Product code: SSC-178830
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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: ≥98%
  • 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 69209-73-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 0 Out of Stock Hong Kong Inquiry

69209-73-0 / (2S)-3-methyl-2-[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]butanoic acid

Standard CAS: 69209-73-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
69209-73-0
Multi CAS
Yes
Molecular Formula
C15H28N2O5
Molecular Weight
316.390000
Exact Mass
316.199822
InChI
InChI=1S/C15H28N2O5/c1-8(2)10(17-14(21)22-15(5,6)7)12(18)16-11(9(3)4)13(19)20/h8-11H,1-7H3,(H,16,18)(H,17,21)(H,19,20)/t10-,11-/m0/s1
InChIKey
IBABAURSJXMCQJ-QWRGUYRKSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Fraction Csp3
0.8
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
3
Molar refractivity
82.4
TPSA
104.73

LogP / Solubility

WLOGP
1.76
MLOGP
1.56
XLogP3
2.3
Consensus LogP
1.87
Log S (ESOL)
-2.52
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.43
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.9
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.4

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5

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