![CAS 683274-69-3 6-T-BUTYL-4-PIPERAZINOTHIENO[3,2-D]PYRIMIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/683274-69-3.gif)
CAS RN: 683274-69-3
6-T-BUTYL-4-PIPERAZINOTHIENO[3,2-D]PYRIMIDINE
- Product code: SSC-178094
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: ＞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 |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
683274-69-3 / 6-tert-butyl-4-piperazin-1-ylthieno[3,2-d]pyrimidine
Basic Information
CAS
683274-69-3
Multi CAS
Yes
Molecular Formula
C14H20N4S
Molecular Weight
276.400000
Exact Mass
276.140868
InChI
InChI=1S/C14H20N4S/c1-14(2,3)11-8-10-12(19-11)13(17-9-16-10)18-6-4-15-5-7-18/h8-9,15H,4-7H2,1-3H3
InChIKey
RTTFMVNTEYTYHA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
9
Fraction Csp3
0.57
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
81.2
TPSA
41.05
LogP / Solubility
WLOGP
2.4
MLOGP
2.12
XLogP3
2.8
Consensus LogP
2.44
Log S (ESOL)
-3.35
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.56
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.57
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.7
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
3-(aminomethyl)-5-chloroaniline
- CAS RN: 683740-35-4
- Product Code: starshine_CAS683740-35-4
- Purity/Analytical method: >99.0%
-
4-FLUORO-3-HYDROXY (1H)INDAZOLE
- CAS RN: 683748-50-7
- Product Code: starshine_CAS683748-50-7
- Purity/Analytical method: >99.0%
-
2-[1-(3-AMINOPROPYL)-1H-INDOL-3-YL]-3-(1H-INDOL-3-YL)MALEIMIDE, HCL
- CAS RN: 683775-59-9
- Product Code: starshine_CAS683775-59-9
- Purity/Analytical method: >99.0%
-
(6-chloropyridin-3-yl)methanesulfonyl chloride
- CAS RN: 683813-60-7
- Product Code: starshine_CAS683813-60-7
- Purity/Analytical method: >99.0%
![CAS 683775-59-9 2-[1-(3-AMINOPROPYL)-1H-INDOL-3-YL]-3-(1H-INDOL-3-YL)MALEIMIDE, HCL molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB8483537.gif)
