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CAS 73532-83-9 1-arabinofuranosylcytosine-5′-stearylphosphate molecular structure lightbox
CAS RN: 73532-83-9

1-arabinofuranosylcytosine-5′-stearylphosphate

  • Product code: SSC-182954
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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: 0.05g, 0.1g, 0.25g
  • Available purity: >97%
  • Inventory rows with stock: 3
  • 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 73532-83-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.05g >97% 1 In Stock Hong Kong Inquiry
0.1g >97% 1 In Stock Hong Kong Inquiry
0.25g >97% 1 In Stock Hong Kong Inquiry

73532-83-9 / [(2R,3S,4S)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl octadecyl hydrogen phosphate

Standard CAS: 73532-83-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
73532-83-9
Multi CAS
Yes
Molecular Formula
C27H50N3O8P
Molecular Weight
575.700000
Exact Mass
575.333553
InChI
InChI=1S/C27H50N3O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-36-39(34,35)37-21-22-24(31)25(32)26(38-22)30-19-18-23(28)29-27(30)33/h18-19,22,24-26,31-32H,2-17,20-21H2,1H3,(H,34,35)(H2,28,29,33)/t22-,24-,25+,26-/m1/s1
InChIKey
YJTVZHOYBAOUTO-URBBEOKESA-N

Computed Properties

Structural Parameters

Heavy atom count
39
Aromatic heavy atom count
6
Fraction Csp3
0.85
Rotatable bonds
22
H-bond acceptors
10
H-bond donors
4
Molar refractivity
150.11
TPSA
166.36

LogP / Solubility

WLOGP
4.84
MLOGP
4.3
XLogP3
5.9
Consensus LogP
5.01
Log S (ESOL)
-5.12
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.77
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.06
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.8

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6.5

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