CAS RN: 62023-90-9
juncusol
Product Availability
Choose a grade to view its available package options.
3 package records0 with current stock1 grade group
- Product code: starshine_CAS62023-90-9
- Purity/Analytical Methods: >99.0%
62023-90-9 / 5-ethenyl-1,6-dimethyl-9,10-dihydrophenanthrene-2,7-diol
Basic Information
CAS
62023-90-9
Multi CAS
Yes
Molecular Formula
C18H18O2
Molecular Weight
266.300000
Exact Mass
266.130680
InChI
InChI=1S/C18H18O2/c1-4-13-10(2)17(20)9-12-5-6-14-11(3)16(19)8-7-15(14)18(12)13/h4,7-9,19-20H,1,5-6H2,2-3H3
InChIKey
XNVMKPYDOHZJLR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.22
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
82.18
TPSA
40.46
LogP / Solubility
WLOGP
4.12
MLOGP
3.64
XLogP3
4.6
Consensus LogP
4.12
Log S (ESOL)
-4.47
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.72
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.93
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.42
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
GLYCYL-L-HISTIDYL-L-LYSINE ACETATE HEMIHYDRATE, 99
- CAS RN: 62024-09-3
- Product Code: starshine_CAS62024-09-3
- Purity/Analytical method: >99.0%
-
-
2-AMINO-N-PROPYLACETAMIDE
- CAS RN: 62029-81-6
- Product Code: starshine_CAS62029-81-6
- Purity/Analytical method: >99.0%
-
-
4-tert-ButylbenzhydroxaMic Acid
- CAS RN: 62034-73-5
- Product Code: starshine_CAS62034-73-5
- Purity/Analytical method: >99.0%
-
1,3,4-Oxadiazol-2-amine,5-(3,4-dichlorophenyl)-
- CAS RN: 62035-95-4
- Product Code: starshine_CAS62035-95-4
- Purity/Analytical method: >99.0%
