![CAS 1228632-34-5 1-phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-phenanthro[9,10-d]imidazole molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1228632-34-5.gif)
CAS RN: 1228632-34-5
1-phenyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-phenanthro[9,10-d]imidazole
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.20260615 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-026493
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
1228632-34-5 / 3-phenyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phenanthro[9,10-d]imidazole
Basic Information
CAS
1228632-34-5
Multi CAS
No
Molecular Formula
C33H29BN2O2
Molecular Weight
496.400000
Exact Mass
496.232208
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C3=NC4=C(N3C5=CC=CC=C5)C6=CC=CC=C6C7=CC=CC=C74
InChI
InChI=1S/C33H29BN2O2/c1-32(2)33(3,4)38-34(37-32)23-20-18-22(19-21-23)31-35-29-27-16-10-8-14-25(27)26-15-9-11-17-28(26)30(29)36(31)24-12-6-5-7-13-24/h5-21H,1-4H3
InChIKey
FNOBGUBLXGONLO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
38
Aromatic heavy atom count
29
Fraction Csp3
0.18
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
157.23
TPSA
36.28
LogP / Solubility
WLOGP
7.3
MLOGP
6.46
XLogP3
7.3
Consensus LogP
7.02
Log S (ESOL)
-7.88
Class (ESOL)
Insoluble
Log S (Ali)
-8.9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.3
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
Yes
Log Kp (skin permeation)
-0.57
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
6
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