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CAS 82882-71-1 L-Histidine, N-[(phenylMethoxy)carbonyl]-1-(triphenylMethyl)- molecular structure lightbox
CAS RN: 82882-71-1

L-Histidine, N-[(phenylMethoxy)carbonyl]-1-(triphenylMethyl)-

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260412 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-190899
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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: ≥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 82882-71-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

82882-71-1 / (2S)-2-(phenylmethoxycarbonylamino)-3-(1-tritylimidazol-4-yl)propanoic acid

Standard CAS: 82882-71-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
82882-71-1
Multi CAS
Yes
Molecular Formula
C33H29N3O4
Molecular Weight
531.600000
Exact Mass
531.215806
InChI
InChI=1S/C33H29N3O4/c37-31(38)30(35-32(39)40-23-25-13-5-1-6-14-25)21-29-22-36(24-34-29)33(26-15-7-2-8-16-26,27-17-9-3-10-18-27)28-19-11-4-12-20-28/h1-20,22,24,30H,21,23H2,(H,35,39)(H,37,38)/t30-/m0/s1
InChIKey
FPKLLLWMALGTOD-PMERELPUSA-N

Computed Properties

Structural Parameters

Heavy atom count
40
Aromatic heavy atom count
29
Fraction Csp3
0.12
Rotatable bonds
10
H-bond acceptors
5
H-bond donors
2
Molar refractivity
151.72
TPSA
93.45

LogP / Solubility

WLOGP
5.65
MLOGP
5.01
XLogP3
5.9
Consensus LogP
5.52
Log S (ESOL)
-6.57
Class (ESOL)
Insoluble
Log S (Ali)
-8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.95

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.56
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5.5

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