CAS RN: 97743-99-2
RAC DESMETHYL CITALOPRAM 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.20251111 | 5mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS97743-99-2
- Purity/Analytical Methods: >99.0%
97743-99-2 / 1-(4-fluorophenyl)-1-[3-(methylamino)propyl]-3H-2-benzofuran-5-carbonitrile
Basic Information
CAS
97743-99-2
Multi CAS
Yes
Molecular Formula
C19FH19N2O
Molecular Weight
310.400000
Exact Mass
310.148141
InChI
InChI=1S/C19H19FN2O.ClH/c1-22-10-2-9-19(16-4-6-17(20)7-5-16)18-8-3-14(12-21)11-15(18)13-23-19;/h3-8,11,22H,2,9-10,13H2,1H3;1H
InChIKey
DYIZNULSIBGJPJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.32
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
1
Molar refractivity
86.29
TPSA
45.05
LogP / Solubility
WLOGP
3.47
MLOGP
3.07
XLogP3
2.8
Consensus LogP
3.11
Log S (ESOL)
-4.01
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.61
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.16
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.15
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3
Customers Also Viewed
-
Pseudoginsenoside Rh1
- CAS RN: 97744-96-2
- Product Code: starshine_CAS97744-96-2
- Purity/Analytical method: >99.0%
-
-
(R)-2-AMINO-3-(5-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID
- CAS RN: 97749-24-1
- Product Code: SSC-212362
-
S 186
- CAS RN: 97759-16-5
- Product Code: starshine_CAS97759-16-5
- Purity/Analytical method: >99.0%
-
4′-Amino-3′-chloro-5′-(trifluoromethyl)acetophenon
- CAS RN: 97760-76-4
- Product Code: SSC-212367
-
1-(4-amino-3-chloro-5-(trifluoromethyl)phenyl)-2-bromoethanone
- CAS RN: 97760-87-7
- Product Code: starshine_CAS97760-87-7
- Purity/Analytical method: >99.0%
