CAS RN: 54767-75-8
SULOCTIDIL
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250519 | 5mg / 25mg / 100mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS54767-75-8
- Purity/Analytical Methods: >99.0%
54767-75-8 / 2-(octylamino)-1-(4-propan-2-ylsulfanylphenyl)propan-1-ol
Basic Information
CAS
54767-75-8
Multi CAS
Yes
Molecular Formula
C20H35NOS
Molecular Weight
337.600000
Exact Mass
337.243936
InChI
InChI=1S/C20H35NOS/c1-5-6-7-8-9-10-15-21-17(4)20(22)18-11-13-19(14-12-18)23-16(2)3/h11-14,16-17,20-22H,5-10,15H2,1-4H3/t17-,20-/m1/s1
InChIKey
BFCDFTHTSVTWOG-YLJYHZDGSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
6
Fraction Csp3
0.7
Rotatable bonds
12
H-bond acceptors
3
H-bond donors
2
Molar refractivity
103.24
TPSA
32.26
LogP / Solubility
WLOGP
5.56
MLOGP
4.91
XLogP3
5.8
Consensus LogP
5.42
Log S (ESOL)
-4.84
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.34
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.91
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.83
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
-
Quinoline, 1,2,3,4-tetrahydro-6-(1-methylethyl)- (9CI)
- CAS RN: 54768-19-3
- Product Code: SSC-162595
-
-
2-Oxo-5-chloro-2,3-dihydrobenzothiazole-3-acetic acid
- CAS RN: 54769-25-4
- Product Code: starshine_CAS54769-25-4
- Purity/Analytical method: >99.0%
-
-
