CAS RN: 932162-80-6
4-(4-BroMophenyl)-2-chloropyriMidine
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260502 |
100mg / 250mg / 1g |
Out of stock |
8-10 business days | Inquiry |
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Product code:
starshine_CAS932162-80-6
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Purity/Analytical Methods:
>99.0%
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932162-80-6 / 4-(4-bromophenyl)-2-chloropyrimidine
Standard CAS: 932162-80-6
Multi CAS: No
Basic Information
CAS
932162-80-6
Multi CAS
No
Molecular Formula
C10H6BRCLN2
Molecular Weight
269.520000
Exact Mass
267.940290
InChI
InChI=1S/C10H6BrClN2/c11-8-3-1-7(2-4-8)9-5-6-13-10(12)14-9/h1-6H
InChIKey
KRYQVNMBOLJHAD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
60.18
TPSA
25.78
LogP / Solubility
WLOGP
3.56
MLOGP
3.14
XLogP3
3.5
Consensus LogP
3.4
Log S (ESOL)
-4.32
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.34
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.49
Class (SILICOS-IT)
Slightly 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)
-1.84
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5