![CAS 1268524-71-5 (R)-(-)-tert-Butyl 2-(4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl)acetate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1268524-71-5.gif)
CAS RN: 1268524-71-5
(R)-(-)-tert-Butyl 2-(4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl)acetate
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250814 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260427 | 1g | Out of stock | Inquiry | ||
| Batchno.20250912 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260208 | 25mg | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250722 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260430 | 5mg | In stock | Shandong | Inquiry |
- Product code: SSC-034124
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: 0.25g
- 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 |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
1268524-71-5 / tert-butyl 2-[(9R)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]acetate
Basic Information
CAS
1268524-71-5
Multi CAS
No
Molecular Formula
C23H25ClN4O2S
Molecular Weight
457.000000
Exact Mass
456.138675
SMILES
CC1=C(SC2=C1C(=N[C@@H](C3=NN=C(N32)C)CC(=O)OC(C)(C)C)C4=CC=C(C=C4)Cl)C
InChI
InChI=1S/C23H25ClN4O2S/c1-12-13(2)31-22-19(12)20(15-7-9-16(24)10-8-15)25-17(11-18(29)30-23(4,5)6)21-27-26-14(3)28(21)22/h7-10,17H,11H2,1-6H3/t17-/m1/s1
InChIKey
DNVXATUJJDPFDM-QGZVFWFLSA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
16
Fraction Csp3
0.39
Rotatable bonds
3
H-bond acceptors
7
Molar refractivity
123.74
TPSA
69.37
LogP / Solubility
WLOGP
5.53
MLOGP
4.9
XLogP3
4.9
Consensus LogP
5.11
Log S (ESOL)
-6.34
Class (ESOL)
Insoluble
Log S (Ali)
-7.3
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.58
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.58
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-3-carboxylate
- CAS RN: 1268619-58-4
- Product Code: SSC-034126
-
5-(furan-2-yl)-N-(4-(pyridin-4-yl)butyl)isoxazole-3-carboxaMide
- CAS RN: 1268674-16-3
- Product Code: starshine_CAS1268674-16-3
- Purity/Analytical method: >99.0%
-
(5-(HydroxyMethyl)thiophen-3-yl)boronic acid
- CAS RN: 1268683-45-9
- Product Code: SSC-034131
-
“4-(anthracen-9-yl)-3-(tertbutyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole”
- CAS RN: 1268693-24-8
- Product Code: SSC-034135
-
CAY10678
- CAS RN: 1268709-57-4
- Product Code: starshine_CAS1268709-57-4
- Purity/Analytical method: >99.0%
-
![CAS 1268693-24-8 “4-(anthracen-9-yl)-3-(tertbutyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole” molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1268693-24-8.gif)
