CAS RN: 2055602-83-8
BAY-1797
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock2 grade groups
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250320 | 25mg / 50mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS2055602-83-8
- Purity/Analytical Methods: >99.0%
2055602-83-8 / N-[4-(3-chlorophenoxy)-3-sulfamoylphenyl]-2-phenylacetamide
Basic Information
CAS
2055602-83-8
Multi CAS
No
Molecular Formula
C20H17ClN2O4S
Molecular Weight
416.900000
Exact Mass
416.059756
SMILES
C1=CC=C(C=C1)CC(=O)NC2=CC(=C(C=C2)OC3=CC(=CC=C3)Cl)S(=O)(=O)N
InChI
InChI=1S/C20H17ClN2O4S/c21-15-7-4-8-17(12-15)27-18-10-9-16(13-19(18)28(22,25)26)23-20(24)11-14-5-2-1-3-6-14/h1-10,12-13H,11H2,(H,23,24)(H2,22,25,26)
InChIKey
CSJYMAFXYMYNCK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
18
Fraction Csp3
0.05
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
2
Molar refractivity
108.12
TPSA
98.49
LogP / Solubility
WLOGP
3.96
MLOGP
3.51
XLogP3
3.9
Consensus LogP
3.79
Log S (ESOL)
-5
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.84
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.38
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)
-2.45
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
-
![CAS 2055646-22-3 Propanoic acid, 3-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]-, 2,5-dioxo-1-pyrrolidinyl ester molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Propanoic acid, 3-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]-, 2,5-dioxo-1-pyrrolidinyl ester
- CAS RN: 2055646-22-3
- Product Code: starshine_CAS2055646-22-3
- Purity/Analytical method: >99.0%
-
-
Thieno[3,2-b]thiophene-3-carboxylic acid
- CAS RN: 2055722-84-2
- Product Code: starshine_CAS2055722-84-2
- Purity/Analytical method: >99.0%
-
4TCzBN
- CAS RN: 2055722-93-3
- Product Code: starshine_CAS2055722-93-3
- Purity/Analytical method: >99.0%
-
4-[1-[3-(cyanomethyl)-1-(ethylsulfonyl)-3-azetidinyl]-1H-pyrazol-4-yl]-7H-Pyrrolo[2,3-d]pyrimidine-7-carboxylic acid 1,1-dimethylethyl ester
- CAS RN: 2055723-13-0
- Product Code: starshine_CAS2055723-13-0
- Purity/Analytical method: >99.0%
-
2-amino-3-chloro-4-mercaptopyridine
- CAS RN: 2055759-40-3
- Product Code: starshine_CAS2055759-40-3
- Purity/Analytical method: >99.0%
![CAS 2055646-22-3 Propanoic acid, 3-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]-, 2,5-dioxo-1-pyrrolidinyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2055646-22-3.png)
![CAS 2055722-84-2 Thieno[3,2-b]thiophene-3-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2055722-84-2.png)
![CAS 2055723-13-0 4-[1-[3-(cyanomethyl)-1-(ethylsulfonyl)-3-azetidinyl]-1H-pyrazol-4-yl]-7H-Pyrrolo[2,3-d]pyrimidine-7-carboxylic acid 1,1-dimethylethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2055723-13-0.png)
