CAS RN: 80251-32-7
NafaMostat (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.20250224 | 10mg / 50mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS80251-32-7
- Purity/Analytical Methods: >99.0%
80251-32-7 / (6-carbamimidoylnaphthalen-2-yl) 4-(diaminomethylideneamino)benzoate;dihydrochloride
Basic Information
CAS
80251-32-7
Multi CAS
Yes
Molecular Formula
C19H19CL2N5O2
Molecular Weight
420.300000
Exact Mass
419.091580
InChI
InChI=1S/C19H17N5O2.2ClH/c20-17(21)14-2-1-13-10-16(8-5-12(13)9-14)26-18(25)11-3-6-15(7-4-11)24-19(22)23;;/h1-10H,(H3,20,21)(H4,22,23,24);2*1H
InChIKey
GKGJACPQHBIISL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
16
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
4
Molar refractivity
116.33
TPSA
140.57
LogP / Solubility
WLOGP
3.09
MLOGP
2.75
XLogP3
3.09
Consensus LogP
2.98
Log S (ESOL)
-4.55
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.24
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.44
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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