CAS RN: 1185864-38-3
9-Bromoanthracene-10- Benzene-D5
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.20250903 | 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1185864-38-3
- Purity/Analytical Methods: >99.0%
1185864-38-3 / 9-bromo-10-(2,3,4,5,6-pentadeuteriophenyl)anthracene
9-Bromoanthracene-10- Benzene-D5 | SCHEMBL15197487 | 9-Bromo-10-(phenyl-2,3,4,5,6-d5)anthracene
Basic Information
CAS
1185864-38-3
Multi CAS
No
Molecular Formula
C20H13Br
Molecular Weight
338.300000
Exact Mass
337.051450
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])C2=C3C=CC=CC3=C(C4=CC=CC=C42)Br)[2H])[2H]
InChI
InChI=1S/C20H13Br/c21-20-17-12-6-4-10-15(17)19(14-8-2-1-3-9-14)16-11-5-7-13-18(16)20/h1-13H/i1D,2D,3D,8D,9D
InChIKey
WHGGVVHVBFMGSG-NWCULCSXSA-N
Synonyms
9-Bromoanthracene-10- Benzene-D5
SCHEMBL15197487
9-Bromo-10-(phenyl-2,3,4,5,6-d5)anthracene
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
20
Rotatable bonds
1
Molar refractivity
94.59
TPSA
0.0000
LogP / Solubility
WLOGP
6.42
MLOGP
5.67
XLogP3
6.7
Consensus LogP
6.26
Log S (ESOL)
-6.59
Class (ESOL)
Insoluble
Log S (Ali)
-6.93
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.28
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
(S)-3-((2R,5S)-5-(4-fluorophenyl)-2-((S)-(4-fluorophenylaMino)(4-hydroxyphenyl)Methyl)-5-hydroxypentanoyl)-4-phenyloxazolidin-2-one
- CAS RN: 1185883-40-2
- Product Code: starshine_CAS1185883-40-2
- Purity/Analytical method: >99.0%
-
(4,8-Bis(5-octylthiophen-2-yl)benzo[1,2-b:4,5-b’]dithiophene-2,6-diyl)bis(trimethylstannane)
- CAS RN: 1185885-87-3
- Product Code: starshine_CAS1185885-87-3
- Purity/Analytical method: >99.0%
-
9-(EICOSAN-11-YL)-2,7-BIS(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-9H-CARBAZOLE
- CAS RN: 1185885-88-4
- Product Code: starshine_CAS1185885-88-4
- Purity/Analytical method: >99.0%
-
2′-(Dicyclohexylphosphino)-N,N-dimethyl[1,1′-biphenyl]-4-amine
- CAS RN: 1185899-00-6
- Product Code: SSC-018436
-
3,3′,5,5′-tetrakis(pyridin-4-ylethynyl)-1,1′-biphenyl
- CAS RN: 1185909-06-1
- Product Code: starshine_CAS1185909-06-1
- Purity/Analytical method: >99.0%
-
Vitexdoin A
- CAS RN: 1186021-77-1
- Product Code: starshine_CAS1186021-77-1
- Purity/Analytical method: >99.0%
![CAS 1185885-87-3 (4,8-Bis(5-octylthiophen-2-yl)benzo[1,2-b:4,5-b’]dithiophene-2,6-diyl)bis(trimethylstannane) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1185885-87-3.gif)
![CAS 1185899-00-6 2′-(Dicyclohexylphosphino)-N,N-dimethyl[1,1′-biphenyl]-4-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1185899-00-6.gif)
