CAS RN: 922719-77-5
(4-(4-PYRIDYLOXY)PHENYL)SULFONYL CHLORIDE HYDROCHLORIDE
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.20250301 | 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS922719-77-5
- Purity/Analytical Methods: >99.0%
922719-77-5 / 4-(bromomethyl)-2-fluoro-1-phenylmethoxybenzene
Basic Information
CAS
922719-77-5
Multi CAS
No
Molecular Formula
BC14H12ORf
Molecular Weight
295.150000
Exact Mass
294.005560
InChI
InChI=1S/C14H12BrFO/c15-9-12-6-7-14(13(16)8-12)17-10-11-4-2-1-3-5-11/h1-8H,9-10H2
InChIKey
YCHITSDJFZQYMX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
4
H-bond acceptors
1
Molar refractivity
69.81
TPSA
9.23
LogP / Solubility
WLOGP
4.3
MLOGP
3.8
XLogP3
4
Consensus LogP
4.03
Log S (ESOL)
-4.64
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.08
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.63
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)
-1.47
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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![CAS 922732-52-3 rel-N,N”-[[(1R,3S,4S,6R)-4,6-Bis[(aminoiminomethyl)amino]-1,3-cyclohexanedyil]bis(oxy-4,1-phenylene)]bisguanidine tetratrifluoroacetate salt molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/922732-52-3.gif)
