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CAS 1267663-32-0 6-hydroxy-1,3-dimethyl-2,4(1H,3H)-Quinazolinedione molecular structure lightbox
CAS RN: 1267663-32-0

6-hydroxy-1,3-dimethyl-2,4(1H,3H)-Quinazolinedione

  • Product code: SSC-033938
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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, 0.1g, 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 2
  • 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 1267663-32-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 3 In Stock Beijing Inquiry
5g ≥95% 1 In Stock Shanghai Inquiry
0.1g ≥95% 0 Out of Stock Beijing Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry

1267663-32-0 / 6-hydroxy-1,3-dimethylquinazoline-2,4-dione

Standard CAS: 1267663-32-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1267663-32-0
Multi CAS
No
Molecular Formula
C10H10N2O3
Molecular Weight
206.200000
Exact Mass
206.069142
SMILES
CN1C2=C(C=C(C=C2)O)C(=O)N(C1=O)C
InChI
InChI=1S/C10H10N2O3/c1-11-8-4-3-6(13)5-7(8)9(14)12(2)10(11)15/h3-5,13H,1-2H3
InChIKey
AGHJHORNXUKEBY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
56.09
TPSA
64.23

LogP / Solubility

WLOGP
-0.06
MLOGP
-0.05
XLogP3
0.5
Consensus LogP
0.13
Log S (ESOL)
-1.58
Class (ESOL)
Soluble
Log S (Ali)
-1.21
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.95
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
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)
-4.02

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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