CAS RN: 1872387-43-3
DC661
Product Availability
Choose a grade to view its available package options.
9 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250405 | 100mg | Out of stock | Inquiry | |
| Batchno.20251104 | 10mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20250907 | 1g | Out of stock | Inquiry | |
| Batchno.20251123 | 1mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20251102 | 250mg | Out of stock | Inquiry | |
| Batchno.20251117 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260224 | 2mg / 5mg / 10mg / 50mg | Confirm by inquiry | Shanghai | Inquiry |
| Batchno.20251207 | 50mg | Out of stock | Inquiry | |
| Batchno.20260628 | 5mg | In stock | Shanghai, Tianjin | Inquiry |
- Product code: starshine_CAS1872387-43-3
- Purity/Analytical Methods: >99.0%
1872387-43-3 / N-(7-chloroquinolin-4-yl)-N'-[6-[(7-chloroquinolin-4-yl)amino]hexyl]-N'-methylhexane-1,6-diamine
Basic Information
CAS
1872387-43-3
Multi CAS
No
Molecular Formula
C31H39Cl2N5
Molecular Weight
552.600000
Exact Mass
551.258252
SMILES
CN(CCCCCCNC1=C2C=CC(=CC2=NC=C1)Cl)CCCCCCNC3=C4C=CC(=CC4=NC=C3)Cl
InChI
InChI=1S/C31H39Cl2N5/c1-38(20-8-4-2-6-16-34-28-14-18-36-30-22-24(32)10-12-26(28)30)21-9-5-3-7-17-35-29-15-19-37-31-23-25(33)11-13-27(29)31/h10-15,18-19,22-23H,2-9,16-17,20-21H2,1H3,(H,34,36)(H,35,37)
InChIKey
VJKCWFZTSDXOBS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
38
Aromatic heavy atom count
20
Fraction Csp3
0.42
Rotatable bonds
16
H-bond acceptors
5
H-bond donors
2
Molar refractivity
164.92
TPSA
53.08
LogP / Solubility
WLOGP
8.67
MLOGP
7.67
XLogP3
8.3
Consensus LogP
8.21
Log S (ESOL)
-8.06
Class (ESOL)
Insoluble
Log S (Ali)
-10.35
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.36
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.06
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5
Customers Also Viewed
-
![CAS 1872392-82-9 6-methoxy-1-methyl-pyrrolo[2,3-b]pyridine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
-
Kimcuongin
- CAS RN: 1872403-23-0
- Product Code: starshine_CAS1872403-23-0
- Purity/Analytical method: >99.0%
-
“1,3,2-Dioxaborolane,4,4,5,5-tertramethyl-2-[1,1″”:3′:1″”-terphenyl]-2-yl-“
- CAS RN: 1872426-73-7
- Product Code: starshine_CAS1872426-73-7
- Purity/Analytical method: >99.0%
-
-
-
1,1,1-Trifluoroethyl-PEG4-amine
- CAS RN: 1872433-72-1
- Product Code: starshine_CAS1872433-72-1
- Purity/Analytical method: >99.0%
![CAS 1872392-82-9 6-methoxy-1-methyl-pyrrolo[2,3-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1872392-82-9.gif)
![CAS 1872426-73-7 “1,3,2-Dioxaborolane,4,4,5,5-tertramethyl-2-[1,1″”:3′:1″”-terphenyl]-2-yl-“ molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1872426-73-7.gif)
