![CAS 19350-69-7 Benzenesulfonic acid,4-methyl-, 2-[(4-chlorophenyl)methylene]hydrazide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/19350-69-7.gif)
CAS RN: 19350-69-7
Benzenesulfonic acid,4-methyl-, 2-[(4-chlorophenyl)methylene]hydrazide
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.20260315 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS19350-69-7
- Purity/Analytical Methods: >99.0%
19350-69-7 / N-[(E)-(4-chlorophenyl)methylideneamino]-4-methylbenzenesulfonamide
Basic Information
CAS
19350-69-7
Multi CAS
No
Molecular Formula
C14H13ClN2O2S
Molecular Weight
308.800000
Exact Mass
308.038627
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H13ClN2O2S/c1-11-2-8-14(9-3-11)20(18,19)17-16-10-12-4-6-13(15)7-5-12/h2-10,17H,1H3/b16-10+
InChIKey
HAYVMYJAVSRNGS-MHWRWJLKSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
80.55
TPSA
58.53
LogP / Solubility
WLOGP
2.96
MLOGP
2.62
XLogP3
3.5
Consensus LogP
3.03
Log S (ESOL)
-3.8
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.23
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.6
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.5
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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- CAS RN: 19350-72-2
- Product Code: starshine_CAS19350-72-2
- Purity/Analytical method: >99.0%
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