CAS RN: 1185316-70-4
(3-AMino-piperidin-1-yl)-thiophen-3-yl-Methanone hydrochloride, 98+% C10H15ClN2OS, MW: 246.76
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.20251214 | 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1185316-70-4
- Purity/Analytical Methods: >99.0%
1185316-70-4 / (3-aminopiperidin-1-yl)-thiophen-3-ylmethanone;hydrochloride
(3-Amino-piperidin-1-yl)-thiophen-3-yl-methanone hydrochloride | (3-Aminopiperidin-1-yl)(thiophen-3-yl)methanone hydrochloride | (3-Amino-1-piperidyl)-(3-thienyl)methanone hydrochloride
Basic Information
CAS
1185316-70-4
Multi CAS
No
Molecular Formula
C10H15ClN2OS
Molecular Weight
246.760000
Exact Mass
246.059362
SMILES
C1CC(CN(C1)C(=O)C2=CSC=C2)N.Cl
InChI
InChI=1S/C10H14N2OS.ClH/c11-9-2-1-4-12(6-9)10(13)8-3-5-14-7-8;/h3,5,7,9H,1-2,4,6,11H2;1H
InChIKey
RJMWECMKALQEIU-UHFFFAOYSA-N
Synonyms
(3-Amino-piperidin-1-yl)-thiophen-3-yl-methanone hydrochloride
(3-Aminopiperidin-1-yl)(thiophen-3-yl)methanone hydrochloride
(3-Amino-1-piperidyl)-(3-thienyl)methanone hydrochloride
(3-aminopiperidin-1-yl)-thiophen-3-ylmethanone;hydrochloride
MFCD08752709
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
5
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
64.68
TPSA
46.33
LogP / Solubility
WLOGP
1.73
MLOGP
1.53
XLogP3
1.73
Consensus LogP
1.66
Log S (ESOL)
-2.64
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.83
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.82
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)
-2.99
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
-
1-Piperazin-1-yl-2-thiophen-3-yl-ethanone hydrochloride, 98+%
- CAS RN: 1185316-81-7
- Product Code: starshine_CAS1185316-81-7
- Purity/Analytical method: >99.0%
-
2-[(Piperidin-4-ylMethyl)-aMino]-nicotinic acid Methyl ester coMpoundwith trifluoro-acetic acid, 98+% C15H20F3N3O4, MW: 363.34
- CAS RN: 1185317-13-8
- Product Code: starshine_CAS1185317-13-8
- Purity/Analytical method: >99.0%
-
1-Phenyl-3-(piperidin-3-ylaMino)-propan-1-one hydrochloride, 98+% C14H21ClN2O, MW: 268.79
- CAS RN: 1185317-59-2
- Product Code: starshine_CAS1185317-59-2
- Purity/Analytical method: >99.0%
-
N,N-diMethyl-4-(piperidin-4-yloxy)benzenesulfonaMide hydrochloride, 98+% C13H21ClN2O3S, MW: 320.84
- CAS RN: 1185317-97-8
- Product Code: starshine_CAS1185317-97-8
- Purity/Analytical method: >99.0%
-
2-(4-chloropiperidin-1-yl)isonicotinonitrile, 98+% C11H12ClN3, MW: 221.69
- CAS RN: 1185318-26-6
- Product Code: starshine_CAS1185318-26-6
- Purity/Analytical method: >99.0%
-
N,N-dimethyl-4-(piperazin-1-ylmethyl)benzenesulfonamide hydrochloride
- CAS RN: 1185318-30-2
- Product Code: starshine_CAS1185318-30-2
- Purity/Analytical method: >99.0%
![CAS 1185317-13-8 2-[(Piperidin-4-ylMethyl)-aMino]-nicotinic acid Methyl ester coMpoundwith trifluoro-acetic acid, 98+% C15H20F3N3O4, MW: 363.34 molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1185317-13-8.gif)
