CAS RN: 14910-99-7
Gold(1+), dichloro(1,10-phenanthroline-κN1,κN10)-, chloride (1:1), (SP-4-2)-
Product Availability
Choose a grade to view its available package options.
3 package records0 with current stock1 grade group
- Product code: starshine_CAS14910-99-7
- Purity/Analytical Methods: >99.0%
14910-99-7 / 1,10-phenanthroline;trichlorogold
Basic Information
CAS
14910-99-7
Multi CAS
No
Molecular Formula
C12H8AuCl3N2
Molecular Weight
483.500000
Exact Mass
481.941876
SMILES
C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.Cl[Au](Cl)Cl
InChI
InChI=1S/C12H8N2.Au.3ClH/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;;;;/h1-8H;;3*1H/q;+3;;;/p-3
InChIKey
JAKVEVFPFMDQPF-UHFFFAOYSA-K
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
14
H-bond acceptors
2
Molar refractivity
74.6
TPSA
25.78
LogP / Solubility
WLOGP
4.85
MLOGP
4.3
XLogP3
4.85
Consensus LogP
4.67
Log S (ESOL)
-6.47
Class (ESOL)
Insoluble
Log S (Ali)
-7.03
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.83
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
TRICHLORO(PYRIDINE)GOLD(III)
- CAS RN: 14911-01-4
- Product Code: starshine_CAS14911-01-4
- Purity/Analytical method: >99.0%
-
CesiumStearate
- CAS RN: 14912-91-5
- Product Code: starshine_CAS14912-91-5
- Purity/Analytical method: >99.0%
-
-
-
-
