CAS RN: 634469-41-3
4-Chloro-2-piperazin-1-yl-pyrimidine hydrochloride
- Product code: SSC-173128
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, 5g
- 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.
634469-41-3 / 4-chloro-2-piperazin-1-ylpyrimidine;hydrochloride
Basic Information
CAS
634469-41-3
Multi CAS
Yes
Molecular Formula
C8H12CL2N4
Molecular Weight
235.110000
Exact Mass
234.043902
InChI
InChI=1S/C8H11ClN4.ClH/c9-7-1-2-11-8(12-7)13-5-3-10-4-6-13;/h1-2,10H,3-6H2;1H
InChIKey
VBVIHVWFUKMIGL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
59.37
TPSA
41.05
LogP / Solubility
WLOGP
0.96
MLOGP
0.85
XLogP3
0.96
Consensus LogP
0.92
Log S (ESOL)
-2.15
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.18
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.11
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.47
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 634591-75-6 3,3-Bis-(2-ethyl-hexyloxymethyl)-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
3,3-Bis-(2-ethyl-hexyloxymethyl)-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine
- CAS RN: 634591-75-6
- Product Code: SSC-173146
-
3-hydroxy-7-methyloctanoic acid
- CAS RN: 634602-29-2
- Product Code: starshine_CAS634602-29-2
- Purity/Analytical method: >99.0%
-
ethyl 2-oxo-2,3-dihydro-1H-benzo[d]iMidazole-5-carboxylate
- CAS RN: 634602-84-9
- Product Code: SSC-173151
-
5-broMo-6-Methyl-1H-benzo[d]iMidazol-2(3H)-one
- CAS RN: 634602-92-9
- Product Code: SSC-173152
-
(R)-3-CBZ-2-OXO-IMIDAZOLIDINE-4-CARBOXYLIC ACID
- CAS RN: 634614-25-8
- Product Code: SSC-173154
-
TBPB
- CAS RN: 634616-95-8
- Product Code: starshine_CAS634616-95-8
- Purity/Analytical method: >99.0%
![CAS 634591-75-6 3,3-Bis-(2-ethyl-hexyloxymethyl)-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/634591-75-6.gif)
![CAS 634602-84-9 ethyl 2-oxo-2,3-dihydro-1H-benzo[d]iMidazole-5-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/634602-84-9.gif)
![CAS 634602-92-9 5-broMo-6-Methyl-1H-benzo[d]iMidazol-2(3H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/634602-92-9.gif)
