![CAS 209959-33-1 2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/209959-33-1.gif)
CAS RN: 209959-33-1
2-[BIS(TERT-BUTOXYCARBONYL)AMINO]-5-BROMOPYRIMIDINE
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251106 | 100g | In stock | Shenzhen, Wuhan, Chengdu | Inquiry | |
| Batchno.20250704 | 10g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry | |
| Batchno.20250503 | 25g | In stock | Chengdu | Inquiry | |
| Batchno.20260219 | 5g | In stock | Shanghai | Inquiry | |
| Batchno.20250319 | 5g / 25g / 100g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-099832
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: 25g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 25g | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
209959-33-1 / tert-butyl N-(5-bromopyrimidin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
Basic Information
CAS
209959-33-1
Multi CAS
No
Molecular Formula
C14H20BrN3O4
Molecular Weight
374.230000
Exact Mass
373.063720
SMILES
CC(C)(C)OC(=O)N(C1=NC=C(C=N1)Br)C(=O)OC(C)(C)C
InChI
InChI=1S/C14H20BrN3O4/c1-13(2,3)21-11(19)18(12(20)22-14(4,5)6)10-16-7-9(15)8-17-10/h7-8H,1-6H3
InChIKey
GDKYABNFMXOTAN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.57
Rotatable bonds
1
H-bond acceptors
6
Molar refractivity
84.68
TPSA
81.62
LogP / Solubility
WLOGP
3.92
MLOGP
3.47
XLogP3
3.1
Consensus LogP
3.5
Log S (ESOL)
-4.76
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.46
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.46
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.22
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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- CAS RN: 209961-11-5
- Product Code: starshine_CAS209961-11-5
- Purity/Analytical method: >99.0%
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![CAS 209961-11-5 4-[(pyrazin-2-ylcarbonyl)amino]butanoic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB21746723.gif)
