CAS RN: 1185246-14-3
Amlodipine-d4
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.20250325 | 1mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1185246-14-3
- Purity/Analytical Methods: >99.0%
1185246-14-3 / 3-O-ethyl 5-O-methyl 2-[(2-amino-1,1,2,2-tetradeuterioethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Amlodipine-d4 | DTXSID70670072 | RefChem:1076663
Basic Information
CAS
1185246-14-3
Multi CAS
No
Molecular Formula
C20H25ClN2O5
Molecular Weight
412.900000
Exact Mass
412.170307
SMILES
[2H]C([2H])(C([2H])([2H])OCC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2Cl)C(=O)OCC)N
InChI
InChI=1S/C20H25ClN2O5/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21/h5-8,17,23H,4,9-11,22H2,1-3H3/i9D2,10D2
InChIKey
HTIQEAQVCYTUBX-YQUBHJMPSA-N
Synonyms
Amlodipine-d4
DTXSID70670072
RefChem:1076663
DTXCID80620821
3-O-ethyl 5-O-methyl 2-[(2-amino-1,1,2,2-tetradeuterioethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
8
H-bond acceptors
7
H-bond donors
2
Molar refractivity
105.58
TPSA
99.88
LogP / Solubility
WLOGP
2.27
MLOGP
2.02
XLogP3
3
Consensus LogP
2.43
Log S (ESOL)
-3.43
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.55
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.16
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)
-3.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
Amlodipine d4 Maleate 9 (Racemic)
- CAS RN: 1185246-15-4
- Product Code: starshine_CAS1185246-15-4
- Purity/Analytical method: >99.0%
-
-
2-Desethoxy-2-hydroxy-1H-1-Ethyl Candesartan Cilexetil
- CAS RN: 1185255-99-5
- Product Code: SSC-018340
-
2-Desethoxy-2-hydroxy-2H-2-ethyl Candesartan Cilexetil
- CAS RN: 1185256-03-4
- Product Code: starshine_CAS1185256-03-4
- Purity/Analytical method: >99.0%
-
1-[3-(Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyrrolidin-2-one
- CAS RN: 1185265-61-5
- Product Code: starshine_CAS1185265-61-5
- Purity/Analytical method: >99.0%
-
methyl 1-(4-fluorobenzyl)-1H-indazole-3-carboxylate
- CAS RN: 1185287-50-6
- Product Code: SSC-018345
![CAS 1185265-61-5 1-[3-(Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyrrolidin-2-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1185265-61-5.gif)
