CAS RN: 451-71-8
Glyhexamide
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.20251128 | 1mg / 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS451-71-8
- Purity/Analytical Methods: >99.0%
451-71-8 / 1-cyclohexyl-3-(2,3-dihydro-1H-inden-5-ylsulfonyl)urea
Basic Information
CAS
451-71-8
Multi CAS
Yes
Molecular Formula
C16H22N2O3S
Molecular Weight
322.400000
Exact Mass
322.135114
InChI
InChI=1S/C16H22N2O3S/c19-16(17-14-7-2-1-3-8-14)18-22(20,21)15-10-9-12-5-4-6-13(12)11-15/h9-11,14H,1-8H2,(H2,17,18,19)
InChIKey
NFRPNQDSKJJQGV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
84.19
TPSA
75.27
LogP / Solubility
WLOGP
2.5
MLOGP
2.21
XLogP3
3.6
Consensus LogP
2.77
Log S (ESOL)
-3.42
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.19
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.91
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
