![CAS 885268-82-6 1-(([4-(2-CHLOROPHENOXY)PHENYL]SULFONYL)AMINO)CYCLOHEXANECARBOXYLIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB6315113.gif)
CAS RN: 885268-82-6
1-(([4-(2-CHLOROPHENOXY)PHENYL]SULFONYL)AMINO)CYCLOHEXANECARBOXYLIC ACID
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.20250504 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS885268-82-6
- Purity/Analytical Methods: >99.0%
885268-82-6 / 1-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]cyclohexane-1-carboxylic acid
Basic Information
CAS
885268-82-6
Multi CAS
No
Molecular Formula
C19H20CLNO5S
Molecular Weight
409.900000
Exact Mass
409.075072
InChI
InChI=1S/C19H20ClNO5S/c20-16-6-2-3-7-17(16)26-14-8-10-15(11-9-14)27(24,25)21-19(18(22)23)12-4-1-5-13-19/h2-3,6-11,21H,1,4-5,12-13H2,(H,22,23)
InChIKey
ZBWZAQPUUFCPLM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.32
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
2
Molar refractivity
101.74
TPSA
92.7
LogP / Solubility
WLOGP
4.2
MLOGP
3.72
XLogP3
4.2
Consensus LogP
4.04
Log S (ESOL)
-4.96
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.95
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.53
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.24
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
Tert-butyl 3-(piperidin-4-yl)propylcarbamate
- CAS RN: 885268-87-1
- Product Code: SSC-199285
-
6′-Bromo-2′,3′-dihydro-1’H-spiro[cyclopropane-1,4′-isoquinoline
- CAS RN: 885269-25-0
- Product Code: starshine_CAS885269-25-0
- Purity/Analytical method: >99.0%
-
4-(4′-Chloro-4-biphenylylsulfonylaMino)benzoic acid
- CAS RN: 885269-32-9
- Product Code: starshine_CAS885269-32-9
- Purity/Analytical method: >99.0%
-
N-(4′-Chloro-4-biphenylylsulfonyl)glycine
- CAS RN: 885269-36-3
- Product Code: starshine_CAS885269-36-3
- Purity/Analytical method: >99.0%
-
6-Methylthieno[2,3-d]pyrimidin-4-amine
- CAS RN: 885269-52-3
- Product Code: starshine_CAS885269-52-3
- Purity/Analytical method: >99.0%
-
6-FLUORO-1,2,3,4-TETRAHYDRO-NAPHTHALENE-2-CARBOXYLIC ACID
- CAS RN: 885269-59-0
- Product Code: SSC-199286
![CAS 885269-52-3 6-Methylthieno[2,3-d]pyrimidin-4-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/885269-52-3.gif)
