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CAS 108543-82-4 Z-VAL-MET-OH molecular structure lightbox
CAS RN: 108543-82-4

Z-VAL-MET-OH

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260430 250mg / 1g / 5g / 25g Out of stock 5-7 business days Inquiry
  • Product code: SSC-009813
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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 108543-82-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 0 Out of Stock Hong Kong Inquiry

108543-82-4 / (2S)-2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-methylsulfanylbutanoic acid

NSC322482 | AKOS024431345 | NSC-322482

Standard CAS: 108543-82-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
108543-82-4
Multi CAS
Yes
Molecular Formula
C18H26N2O5S
Molecular Weight
382.500000
Exact Mass
382.156243
SMILES
CC(C)[C@@H](C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C18H26N2O5S/c1-12(2)15(16(21)19-14(17(22)23)9-10-26-3)20-18(24)25-11-13-7-5-4-6-8-13/h4-8,12,14-15H,9-11H2,1-3H3,(H,19,21)(H,20,24)(H,22,23)/t14-,15-/m0/s1
InChIKey
WNRHCSDFQVZROA-GJZGRUSLSA-N
Synonyms
NSC322482 AKOS024431345 NSC-322482 CARBOBENZYLOXY-L-VALYL-L-METHIONINE 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-4-methylsulfanyl-butanoic acid

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
10
H-bond acceptors
5
H-bond donors
3
Molar refractivity
100.95
TPSA
104.73

LogP / Solubility

WLOGP
2.26
MLOGP
2.01
XLogP3
1.8
Consensus LogP
2.02
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.33
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.22
Class (SILICOS-IT)
Slightly 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)
-3.45

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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