CAS RN: 2241594-21-6
(R)-2-(2,5-dichlorophenyl)pyrrolidine hydrochloride
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250122 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2241594-21-6
- Purity/Analytical Methods: >99.0%
2241594-21-6 / (2R)-2-(2,5-dichlorophenyl)pyrrolidine;hydrochloride
Basic Information
CAS
2241594-21-6
Multi CAS
No
Molecular Formula
C10H12Cl3N
Molecular Weight
252.600000
Exact Mass
251.003532
SMILES
C1C[C@@H](NC1)C2=C(C=CC(=C2)Cl)Cl.Cl
InChI
InChI=1S/C10H11Cl2N.ClH/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10;/h3-4,6,10,13H,1-2,5H2;1H/t10-;/m1./s1
InChIKey
PFNXBLVMVXABHJ-HNCPQSOCSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
63.69
TPSA
12.03
LogP / Solubility
WLOGP
3.84
MLOGP
3.39
XLogP3
3.84
Consensus LogP
3.69
Log S (ESOL)
-4.08
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.61
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
No
Log Kp (skin permeation)
-1.53
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
(S)-METHYL 3-AMINO-2,3-DIHYDROBENZOFURAN-5-CARBOXYLATE HYDROCHLORIDE
- CAS RN: 2241594-22-7
- Product Code: starshine_CAS2241594-22-7
- Purity/Analytical method: >99.0%
-
(R)-2-(2-chloro-3-methylphenyl)pyrrolidine hydrochloride
- CAS RN: 2241594-25-0
- Product Code: starshine_CAS2241594-25-0
- Purity/Analytical method: >99.0%
-
(1R)-6-BROMO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-AMINE HYDROCHLORIDE
- CAS RN: 2241594-26-1
- Product Code: starshine_CAS2241594-26-1
- Purity/Analytical method: >99.0%
-
(4R)-7-CHLORO-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-AMINE HYDROCHLORIDE
- CAS RN: 2241594-30-7
- Product Code: starshine_CAS2241594-30-7
- Purity/Analytical method: >99.0%
-
(2S)-2-AMINO-2-(2,4-DIFLUOROPHENYL)ACETIC ACID HYDROCHLORIDE
- CAS RN: 2241594-33-0
- Product Code: starshine_CAS2241594-33-0
- Purity/Analytical method: >99.0%
-
(S)-2-Amino-2-(2,4-difluorophenyl)ethan-1-ol hydrochloride
- CAS RN: 2241594-36-3
- Product Code: starshine_CAS2241594-36-3
- Purity/Analytical method: >99.0%
