Name: Name:(S)-(+)-N-(3,5-Dioxa-4-phosphacyclohepta[2,1-a:3,4-a']dinaphthalen-4-yl)-dibenzo[b,f]azepine
Brand: Angene
SKU: AG00II18
Rating: 90 (10 reviews)

(S)-(+)-N-(3,5-Dioxa-4-phosphacyclohepta[2,1-a:3,4-a']dinaphthalen-4-yl)-dibenzo[b,f]azepine

CAS No.:

942939-38-0

Catalog Number:

AG00II18

Molecular Formula:

C34H42NO2P

Molecular Weight:

527.6765

Catalog Number:

AG00II18

Chemical Name:

(S)-(+)-N-(3,5-Dioxa-4-phosphacyclohepta[2,1-a:3,4-a']dinaphthalen-4-yl)-dibenzo[b,f]azepine

CAS Number:

942939-38-0

Molecular Formula:

C34H42NO2P

Molecular Weight:

527.6765

MDL Number:

MFCD22666424

IUPAC Name:

11-(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)benzo[b][1]benzazepine

InChI:

InChI=1S/C34H22NO2P/c1-5-13-27-23(9-1)19-21-31-33(27)34-28-14-6-2-10-24(28)20-22-32(34)37-38(36-31)35-29-15-7-3-11-25(29)17-18-26-12-4-8-16-30(26)35/h1-22H

InChI Key:

KOVOHCVLXRKTGN-UHFFFAOYSA-N

SMILES:

c1ccc2c(c1)C=Cc1c(N2p2oc3ccc4c(c3c3c(o2)ccc2c3cccc2)cccc4)cccc1

Complexity:

797

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

507.139g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

507.529g/mol

Monoisotopic Mass:

507.139g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

9.9