![CAS 313342-21-1 N-[(1S,2S)-2-aMinocyclohexyl]-3,5-bis(trifluoroMethyl)- BenzenesulfonaMide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/313342-21-1.gif)
CAS RN: 313342-21-1
N-[(1S,2S)-2-aMinocyclohexyl]-3,5-bis(trifluoroMethyl)- BenzenesulfonaMide
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.20260125 | 50mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS313342-21-1
- Purity/Analytical Methods: >99.0%
313342-21-1 / N-(2-aminocyclohexyl)-3,5-bis(trifluoromethyl)benzenesulfonamide
Basic Information
CAS
313342-21-1
Multi CAS
Yes
Molecular Formula
C14F6H16N2O2S
Molecular Weight
390.350000
Exact Mass
390.083668
InChI
InChI=1S/C14H16F6N2O2S/c15-13(16,17)8-5-9(14(18,19)20)7-10(6-8)25(23,24)22-12-4-2-1-3-11(12)21/h5-7,11-12,22H,1-4,21H2
InChIKey
JBCNCYCPWLJXDO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
6
Fraction Csp3
0.57
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
77
TPSA
72.19
LogP / Solubility
WLOGP
3.27
MLOGP
2.9
XLogP3
3.1
Consensus LogP
3.09
Log S (ESOL)
-4.3
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.12
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.27
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.78
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
![CAS 313342-22-2 “1S,2S-N-[3,5-bis(trifluoromethyl)]benzenesulfonamide-1,2-diphenyl ethylenediamine” molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
“1S,2S-N-[3,5-bis(trifluoromethyl)]benzenesulfonamide-1,2-diphenyl ethylenediamine”
- CAS RN: 313342-22-2
- Product Code: SSC-136667
-
N-[(1S,2S)-2-aMino-1,2-diphenylethyl]-2,3,4,5,6-pentafluoro-BenzenesulfonaMide
- CAS RN: 313342-24-4
- Product Code: starshine_CAS313342-24-4
- Purity/Analytical method: >99.0%
-
-
REGADENOSON
- CAS RN: 313348-27-5
- Product Code: starshine_CAS313348-27-5
- Purity/Analytical method: >99.0%
-
1-(4-Aminobutyl)-2-butyl-1H-imidazo[4,5-c]quinolin-4-amine
- CAS RN: 313350-31-1
- Product Code: SSC-136669
-
6-MORPHOLINONICOTINOYL CHLORIDE
- CAS RN: 313350-36-6
- Product Code: starshine_CAS313350-36-6
- Purity/Analytical method: >99.0%
![CAS 313342-22-2 “1S,2S-N-[3,5-bis(trifluoromethyl)]benzenesulfonamide-1,2-diphenyl ethylenediamine” molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/313342-22-2.gif)
![CAS 313342-24-4 N-[(1S,2S)-2-aMino-1,2-diphenylethyl]-2,3,4,5,6-pentafluoro-BenzenesulfonaMide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/313342-24-4.gif)
![CAS 313350-31-1 1-(4-Aminobutyl)-2-butyl-1H-imidazo[4,5-c]quinolin-4-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/313350-31-1.gif)
