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CAS 5167-18-0 1,7-DIHYDRO-2-METHYL-6-PURINONE molecular structure lightbox
CAS RN: 5167-18-0

1,7-DIHYDRO-2-METHYL-6-PURINONE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251106 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-158614
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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: 0.25g, 0.1g, 5g, 10g, 1g
  • 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 5167-18-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 4 In Stock Shanghai Inquiry
0.1g ≥95% 3 In Stock Shanghai Inquiry
5g ≥95% 2 In Stock Shanghai Inquiry
10g ≥95% 2 In Stock Shenzhen Inquiry
1g ≥95% 1 In Stock Beijing Inquiry

5167-18-0 / 2-methyl-1,4-dihydropurin-6-one

Standard CAS: 5167-18-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5167-18-0
Multi CAS
Yes
Molecular Formula
C6H6N4O
Molecular Weight
150.140000
Exact Mass
150.054161
InChI
InChI=1S/C6H6N4O/c1-3-9-5-4(6(11)10-3)7-2-8-5/h2H,1H3,(H2,7,8,9,10,11)
InChIKey
JXLWCABYHOMQHE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.33
H-bond acceptors
4
H-bond donors
1
Molar refractivity
40.97
TPSA
66.18

LogP / Solubility

WLOGP
-0.66
MLOGP
-0.58
XLogP3
-1.1
Consensus LogP
-0.78
Log S (ESOL)
-0.36
Class (ESOL)
Very soluble
Log S (Ali)
-0.32
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.09
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.1

Drug-likeness / Medicinal Chemistry

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

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