![CAS 2102042-41-9 2,4-dichloro-6-(dibenzo[b,d]furan-3-yl)-1,3,5-triazine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2102042-41-9.png)
CAS RN: 2102042-41-9
2,4-dichloro-6-(dibenzo[b,d]furan-3-yl)-1,3,5-triazine
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.20250308 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-100000
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 | Shanghai | Inquiry |
2102042-41-9 / 2,4-dichloro-6-dibenzofuran-3-yl-1,3,5-triazine
Basic Information
CAS
2102042-41-9
Multi CAS
No
Molecular Formula
C15H7Cl2N3O
Molecular Weight
316.100000
Exact Mass
314.996617
SMILES
C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)C4=NC(=NC(=N4)Cl)Cl
InChI
InChI=1S/C15H7Cl2N3O/c16-14-18-13(19-15(17)20-14)8-5-6-10-9-3-1-2-4-11(9)21-12(10)7-8/h1-7H
InChIKey
JRKOKQRGGOTRKQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
19
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
82.56
TPSA
51.81
LogP / Solubility
WLOGP
4.74
MLOGP
4.19
XLogP3
5.3
Consensus LogP
4.74
Log S (ESOL)
-5.39
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.77
Class (SILICOS-IT)
Slightly soluble
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
No
Log Kp (skin permeation)
-1.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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