Velpatasvir intermediate structure, CAS 1378391-44-6

Velpatasvir intermediate

CAS Number1378391-44-6

SynonymsExact Mass 793.416321; LogP 5.88; Index of Refraction 1.602; InChIKey PTAZJSKYQQTDPY-FABOOFKTSA-N; Synonyms

Molecular FormulaC44H55N7O7

Molecular Weight793.950

Purity

Density1.3±0.1 g/cm3

Boiling Point1044.9±65.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

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Symbol

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Cat. No.: 2A-1182031 Purity:
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Quality Control of [ 1378391-44-6 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number1378391-44-6
Catalog No.2A-1182031
Chinese Name叔丁基 (2S,4S)-2-[5-(2-{(2S,5S)-1-[N-(甲氧基羰基)-L-缬氨酰]-5-甲基吡咯烷-2-基}-1,4,5,11-四氢异吡喃[4′,3′:6,7]萘并[1,2-d]咪唑-9
SynonymsExact Mass 793.416321; LogP 5.88; Index of Refraction 1.602; InChIKey PTAZJSKYQQTDPY-FABOOFKTSA-N; Synonyms
Molecular FormulaC44H55N7O7
Molecular Weight793.950
Density1.3±0.1 g/cm3
Boiling Point1044.9±65.0 °C at 760 mmHg
PubChem ID224682820
SMILESCOCC1CC(c2ncc(-c3ccc4c(c3)COc3cc5c(cc3-4)CCc3[nH]c(C4CCC(C)N4C(=O)C(NC(=O)OC)C(C)C)nc3-5)[nH]2)N(C(=O)OC(C)(C)C)C1
InChIInChI=1S/C44H55N7O7/c1-23(2)37(49-42(53)56-8)41(52)51-24(3)9-14-34(51)40-46-32-13-11-26-17-31-29-12-10-27(16-28(29)22-57-36(31)18-30(26)38(32)48-40)33-19-45-39(47-33)35-15-25(21-55-7)20-50(35)43(54)58-44(4,5)6/h10,12,16-19,23-25,34-35,37H,9,11,13-15,20-22H2,1-8H3,(H,45,47)(H,46,48)(H,49,53)/t24-,25-,34-,35-,37-/m0/s1
InChI KeyPTAZJSKYQQTDPY-FABOOFKTSA-N
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