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CAS 45234-13-7 BOC-CIT-OH molecular structure lightbox
CAS RN: 45234-13-7

BOC-CIT-OH

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260123 5g In stock Shandong Inquiry
  • Product code: SSC-153038
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g, 100g
  • Available purity: >95%
  • Inventory rows with stock: 5
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 45234-13-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 5 In Stock Shanghai Inquiry
5g >95% 5 In Stock Shenzhen Inquiry
10g >95% 5 In Stock Hong Kong Inquiry
25g >95% 5 In Stock Shanghai Inquiry
100g >95% 5 In Stock Beijing Inquiry

45234-13-7 / 5-(carbamoylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid

Standard CAS: 45234-13-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
45234-13-7
Multi CAS
Yes
Molecular Formula
C11H21N3O5
Molecular Weight
275.300000
Exact Mass
275.148121
InChI
InChI=1S/C11H21N3O5/c1-11(2,3)19-10(18)14-7(8(15)16)5-4-6-13-9(12)17/h7H,4-6H2,1-3H3,(H,14,18)(H,15,16)(H3,12,13,17)/t7-/m0/s1
InChIKey
CMJCWQISQGNHHI-ZETCQYMHSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
0.73
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
4
Molar refractivity
67.61
TPSA
130.75

LogP / Solubility

WLOGP
0.41
MLOGP
0.37
Consensus LogP
0.26
Log S (ESOL)
-1.41
Class (ESOL)
Soluble
Log S (Ali)
-2.12
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.51
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.11

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

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