CAS RN: 959986-18-6
thiazole,5-(3-bromophenyl)-2-chloro-
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.20250327 | 250mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS959986-18-6
- Purity/Analytical Methods: >99.0%
959986-18-6 / 5-(3-bromophenyl)-2-chloro-1,3-thiazole
Basic Information
CAS
959986-18-6
Multi CAS
No
Molecular Formula
C9H5BRCLNS
Molecular Weight
274.570000
Exact Mass
272.901460
InChI
InChI=1S/C9H5BrClNS/c10-7-3-1-2-6(4-7)8-5-12-9(11)13-8/h1-5H
InChIKey
WWEMFLPMJMFBLI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
60.26
TPSA
12.89
LogP / Solubility
WLOGP
4.23
MLOGP
3.73
XLogP3
4.3
Consensus LogP
4.09
Log S (ESOL)
-4.76
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.86
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.07
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.39
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
-
6-BROMO-3,4-DIHYDRO-2H-PYRIDO[3,2-B][1,4]OXAZINE
- CAS RN: 959992-62-2
- Product Code: SSC-211769
-
-
6-Trifluoromethyl-3-pyridinesulfonyl Chloride
- CAS RN: 959996-58-8
- Product Code: SSC-211772
![CAS 959992-62-2 6-BROMO-3,4-DIHYDRO-2H-PYRIDO[3,2-B][1,4]OXAZINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/959992-62-2.gif)
