![CAS 740873-06-7 N-[3-[4-[4-[(Cyclohexylmethylsulfonyl)amino]butyl]piperazin-1-yl]phenyl]acetamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/740873-06-7.gif)
CAS RN: 740873-06-7
N-[3-[4-[4-[(Cyclohexylmethylsulfonyl)amino]butyl]piperazin-1-yl]phenyl]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.20260105 | 1mg / 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS740873-06-7
- Purity/Analytical Methods: >99.0%
740873-06-7 / N-[3-[4-[4-(cyclohexylmethylsulfonylamino)butyl]piperazin-1-yl]phenyl]acetamide
Basic Information
CAS
740873-06-7
Multi CAS
No
Molecular Formula
C23H38N4O3S
Molecular Weight
450.600000
Exact Mass
450.266462
InChI
InChI=1S/C23H38N4O3S/c1-20(28)25-22-10-7-11-23(18-22)27-16-14-26(15-17-27)13-6-5-12-24-31(29,30)19-21-8-3-2-4-9-21/h7,10-11,18,21,24H,2-6,8-9,12-17,19H2,1H3,(H,25,28)
InChIKey
SPWZXWDPAWDKQE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
6
Fraction Csp3
0.7
Rotatable bonds
10
H-bond acceptors
5
H-bond donors
2
Molar refractivity
127
TPSA
81.75
LogP / Solubility
WLOGP
3.05
MLOGP
2.71
XLogP3
3.2
Consensus LogP
2.99
Log S (ESOL)
-4.04
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.46
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.32
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.31
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
![CAS 741191-50-4 bromophenyl)methyl]cyclopropan-1-amine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
-
-
6-BROMO-2-BENZOTHIAZOLECARBONITRILE
- CAS RN: 741253-03-2
- Product Code: starshine_CAS741253-03-2
- Purity/Analytical method: >99.0%
-
1,1,2,2-tetrakis(4-(2-(trimethylsilyl)ethynyl)phenyl)ethene
- CAS RN: 741259-14-3
- Product Code: starshine_CAS741259-14-3
- Purity/Analytical method: >99.0%
-
3-Pyrrolidinepropanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2-oxo-, (αS,3S)-
- CAS RN: 741267-75-4
- Product Code: SSC-183526
-
3-(1-(tert-butoxycarbonyl)pyrrolidin-2-yl)acrylic acid
- CAS RN: 741269-02-3
- Product Code: SSC-183528
![CAS 741191-50-4 bromophenyl)methyl]cyclopropan-1-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/741191-50-4.gif)
![CAS 741267-75-4 3-Pyrrolidinepropanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2-oxo-, (αS,3S)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/741267-75-4.gif)
