![CAS 923709-46-0 2-chloro-N-[phenyl(thiophen-2-yl)methyl]acetamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/923709-46-0.gif)
CAS RN: 923709-46-0
2-chloro-N-[phenyl(thiophen-2-yl)methyl]acetamide
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.20250203 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS923709-46-0
- Purity/Analytical Methods: >99.0%
923709-46-0 / 2-chloro-N-[phenyl(thiophen-2-yl)methyl]acetamide
Basic Information
CAS
923709-46-0
Multi CAS
No
Molecular Formula
C13H12CLNOS
Molecular Weight
265.760000
Exact Mass
265.032813
InChI
InChI=1S/C13H12ClNOS/c14-9-12(16)15-13(11-7-4-8-17-11)10-5-2-1-3-6-10/h1-8,13H,9H2,(H,15,16)
InChIKey
KQMOGKJRTUJKAG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
11
Fraction Csp3
0.15
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
71.47
TPSA
29.1
LogP / Solubility
WLOGP
3.19
MLOGP
2.82
XLogP3
3.1
Consensus LogP
3.04
Log S (ESOL)
-3.71
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.04
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.52
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.07
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2
Customers Also Viewed
-
5-ETHOXY-2-THIEN-2-YL-1,3-OXAZOLE-4-CARBOXYLIC ACID
- CAS RN: 923710-57-0
- Product Code: SSC-206013
-
[[4-(3-CHLORO-4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]ACETIC ACID
- CAS RN: 923713-39-7
- Product Code: SSC-206015
-
-
2-(1,3-BENZOTHIAZOL-2-YLMETHYL)-2-ETHYLBUTANOIC ACID
- CAS RN: 923716-18-1
- Product Code: SSC-206017
-
-
2-(5-PHENYL-2H-TETRAZOL-2-YL)ETHANESULFONYL FLUORIDE
- CAS RN: 923723-76-6
- Product Code: SSC-206020
![CAS 923713-39-7 [[4-(3-CHLORO-4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]ACETIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB2794491.gif)
![CAS 923723-55-1 2-[(THIEN-3-YLCARBONYL)AMINO]BENZOIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB0190778.gif)
