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CAS 33858-36-5 2,6-di（benzo（d）oxazol-2-yl）pyridine molecular structure lightbox
CAS RN: 33858-36-5

2,6-di（benzo（d）oxazol-2-yl）pyridine

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4 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250801 100mg Out of stock 8-10 business days Inquiry
Batchno.20250307 100mg Out of stock Inquiry
Batchno.20250924 1g In stock Shanghai Inquiry
Batchno.20250721 250mg In stock Shanghai, Tianjin Inquiry
  • Product code: starshine_CAS33858-36-5
  • Purity/Analytical Methods: >99.0%
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33858-36-5 / 2-[6-(1,3-benzoxazol-2-yl)-2-pyridinyl]-1,3-benzoxazole

Standard CAS: 33858-36-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
33858-36-5
Multi CAS
No
Molecular Formula
C19H11N3O2
Molecular Weight
313.300000
Exact Mass
313.085127
InChI
InChI=1S/C19H11N3O2/c1-3-10-16-12(6-1)21-18(23-16)14-8-5-9-15(20-14)19-22-13-7-2-4-11-17(13)24-19/h1-11H
InChIKey
LABDAMKZNFRJIA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
24
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
90.24
TPSA
64.95

LogP / Solubility

WLOGP
4.7
MLOGP
4.15
XLogP3
3.9
Consensus LogP
4.25
Log S (ESOL)
-5.35
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.52
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.84
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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