CAS RN: 1146080-79-6
2-(2-BroMo-pyridin-3-yloxy)-pyriMidine, 98+% C9H6BrN3O, MW: 252.07
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260418 | 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1146080-79-6
- Purity/Analytical Methods: >99.0%
1146080-79-6 / 2-[(2-bromo-3-pyridinyl)oxy]pyrimidine
2-(2-Bromo-pyridin-3-yloxy)-pyrimidine | 2-(2-bromopyridin-3-yl)oxypyrimidine | 2-bromo-3-pyrimidin-2-yloxypyridine
Basic Information
CAS
1146080-79-6
Multi CAS
No
Molecular Formula
C9H6BrN3O
Molecular Weight
252.070000
Exact Mass
250.969420
SMILES
C1=CC(=C(N=C1)Br)OC2=NC=CC=N2
InChI
InChI=1S/C9H6BrN3O/c10-8-7(3-1-4-11-8)14-9-12-5-2-6-13-9/h1-6H
InChIKey
WKUXGTBJENIFMU-UHFFFAOYSA-N
Synonyms
2-(2-Bromo-pyridin-3-yloxy)-pyrimidine
2-(2-bromopyridin-3-yl)oxypyrimidine
2-bromo-3-pyrimidin-2-yloxypyridine
2-[(2-Bromopyridin-3-yl)oxy]pyrimidine
DTXSID50671845
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
54.04
TPSA
47.9
LogP / Solubility
WLOGP
2.43
MLOGP
2.14
XLogP3
2
Consensus LogP
2.19
Log S (ESOL)
-3.43
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.38
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.55
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.53
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
-
1-(1-(pyridin-2-yl)-1H-pyrrol-2-yl)ethanone, 98+% C11H10N2O, MW: 186.21
- CAS RN: 1146080-86-5
- Product Code: starshine_CAS1146080-86-5
- Purity/Analytical method: >99.0%
-
tert-butyl 3-(6-bromopyridin-3-yl)oxyazetidine-1-carboxylate
- CAS RN: 1146089-80-6
- Product Code: SSC-014314
-
Moracin T
- CAS RN: 1146113-27-0
- Product Code: starshine_CAS1146113-27-0
- Purity/Analytical method: >99.0%
-
(2S)-5-(dimethylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxopentanoic acid
- CAS RN: 1146118-59-3
- Product Code: SSC-014316
-
-
Methyl (2R,4R)-1-Boc-4-aMinopyrrolidine-2-carboxylate
- CAS RN: 1146160-08-8
- Product Code: SSC-014322
