[email protected]
CAS 1211521-89-9 2,3-dibromo-5-methoxypyridine molecular structure lightbox
CAS RN: 1211521-89-9

2,3-dibromo-5-methoxypyridine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260424 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1211521-89-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1211521-89-9 / 2,3-dibromo-5-methoxypyridine

2,3-Dibromo-5-methoxypyridine | MFCD18256791 | SCHEMBL15577521

Standard CAS: 1211521-89-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1211521-89-9
Multi CAS
No
Molecular Formula
C6H5Br2NO
Molecular Weight
266.920000
Exact Mass
266.871740
SMILES
COC1=CC(=C(N=C1)Br)Br
InChI
InChI=1S/C6H5Br2NO/c1-10-4-2-5(7)6(8)9-3-4/h2-3H,1H3
InChIKey
DGGCDSWYPYZWGV-UHFFFAOYSA-N
Synonyms
2,3-Dibromo-5-methoxypyridine MFCD18256791 SCHEMBL15577521 2,3-bis(bromanyl)-5-methoxy-pyridine DB-364337

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
46.19
TPSA
22.12

LogP / Solubility

WLOGP
2.62
MLOGP
2.31
XLogP3
2.5
Consensus LogP
2.48
Log S (ESOL)
-3.52
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.64
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.69
Class (SILICOS-IT)
Poorly 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)
-2.49

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
1.5

Customers Also Viewed

Get In Touch

Contact Us